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Enamines

Enamines

Organic compounds containing an amine group bonded to a carbon atom that is bonded to another carbon atom in a double bond. Enamines are nitrogen analogs of enols.
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1 – 15 of 40 results
1

Thermo Scientific Chemicals Indigo carmine

CAS: 860-22-0 Molecular Formula: C16H8N2Na2O8S2 Molecular Weight (g/mol): 466.35 MDL Number: MFCD00005723 InChI Key: KHLVKKOJDHCJMG-QDBORUFSSA-L Synonym: indigo carmine,indigocarmine,acid blue 74,indigocarmin,indigotindisulfonate sodium,c.i. acid blue 74,food blue no. 2,amacid brilliant blue,c.i. food blue 1,fd&c blue no. 2 PubChem CID: 5284351 SMILES: [Na+].[Na+].[O-]S(=O)(=O)C1=CC=C2N\C(C(=O)C2=C1)=C1\NC2=CC=C(C=C2C1=O)S([O-])(=O)=O

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PubChem CID 5284351
CAS 860-22-0
Molecular Weight (g/mol) 466.35
MDL Number MFCD00005723
SMILES [Na+].[Na+].[O-]S(=O)(=O)C1=CC=C2N\C(C(=O)C2=C1)=C1\NC2=CC=C(C=C2C1=O)S([O-])(=O)=O
Synonym indigo carmine,indigocarmine,acid blue 74,indigocarmin,indigotindisulfonate sodium,c.i. acid blue 74,food blue no. 2,amacid brilliant blue,c.i. food blue 1,fd&c blue no. 2
InChI Key KHLVKKOJDHCJMG-QDBORUFSSA-L
Molecular Formula C16H8N2Na2O8S2
2

Methyl 4-amino-1-benzyl-1,2,5,6-tetrahydropyridine-3-carboxylate, 99%, Thermo Scientific™

CAS: 159660-85-2 Molecular Formula: C14H18N2O2 Molecular Weight (g/mol): 246.31 MDL Number: MFCD00216930 InChI Key: HLKWMBMESNOAMS-UHFFFAOYSA-N Synonym: methyl 4-amino-1-benzyl-1,2,5,6-tetrahydropyridine-3-carboxylate,1-benzyl-4-amino-1,2,5,6-tetrahydropyridine-3-carboxylic acid methyl ester,methyl 4-amino-1-benzyl-1,2,5,6-tetrahydro-3-pyridinecarboxylate #,methyl 4-amino-1-benzyl-5,6-dihydro-2h-pyridine-3-carboxylate,3-pyridinecarboxylicacid, 4-amino-1,2,5,6-tetrahydro-1-phenylmethyl-, methyl ester,4-amino-1-benzyl-1,2,5,6-tetrahydro-pyridine-3-carboxylic acid methyl ester,pyridine-3-carboxylic acid, 1,2,5,6-tetrahydro-4-amino-1-benzyl-, methyl ester PubChem CID: 563385 IUPAC Name: methyl 4-amino-1-benzyl-3,6-dihydro-2H-pyridine-5-carboxylate SMILES: COC(=O)C1=C(CCN(C1)CC2=CC=CC=C2)N

PubChem CID 563385
CAS 159660-85-2
Molecular Weight (g/mol) 246.31
MDL Number MFCD00216930
SMILES COC(=O)C1=C(CCN(C1)CC2=CC=CC=C2)N
Synonym methyl 4-amino-1-benzyl-1,2,5,6-tetrahydropyridine-3-carboxylate,1-benzyl-4-amino-1,2,5,6-tetrahydropyridine-3-carboxylic acid methyl ester,methyl 4-amino-1-benzyl-1,2,5,6-tetrahydro-3-pyridinecarboxylate #,methyl 4-amino-1-benzyl-5,6-dihydro-2h-pyridine-3-carboxylate,3-pyridinecarboxylicacid, 4-amino-1,2,5,6-tetrahydro-1-phenylmethyl-, methyl ester,4-amino-1-benzyl-1,2,5,6-tetrahydro-pyridine-3-carboxylic acid methyl ester,pyridine-3-carboxylic acid, 1,2,5,6-tetrahydro-4-amino-1-benzyl-, methyl ester
IUPAC Name methyl 4-amino-1-benzyl-3,6-dihydro-2H-pyridine-5-carboxylate
InChI Key HLKWMBMESNOAMS-UHFFFAOYSA-N
Molecular Formula C14H18N2O2
3

Thermo Scientific Chemicals 2-(5-Bromo-2-pyridylazo)-5-(diethylamino)phenol, 98%

CAS: 14337-53-2 Molecular Formula: C15H17BrN4O Molecular Weight (g/mol): 349.23 MDL Number: MFCD00006255 InChI Key: LYVSIKOGJUDRBK-QGOAFFKASA-N Synonym: 2-5-bromo-2-pyridylazo-5-diethylamino phenol,2-5-bromopyridin-2-yl diazenyl-5-diethylamino phenol,bromo-padap,2-5-bromo-2-pyridylazo-5-diethylaminophenol,phenol, 2-5-bromo-2-pyridinyl azo-5-diethylamino,2-4-diethylamino-2-hydroxyphenylazo-5-bromopyridine,hnvcxdavehoibp-vhebqxmusa-n,2-5-bromo-2-pyridylazo-5-diethylamino-phenol,5-diethylamino-2-5-bromo 2-pyridyl diazenyl phenol,e-2-5-bromopyridin-2-yl diazenyl-5-diethylamino phenol PubChem CID: 5911417 IUPAC Name: (6E)-6-[(5-bromopyridin-2-yl)hydrazinylidene]-3-(diethylamino)cyclohexa-2,4-dien-1-one SMILES: CCN(CC)C1=CC(=O)\C(C=C1)=N\NC1=CC=C(Br)C=N1

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PubChem CID 5911417
CAS 14337-53-2
Molecular Weight (g/mol) 349.23
MDL Number MFCD00006255
SMILES CCN(CC)C1=CC(=O)\C(C=C1)=N\NC1=CC=C(Br)C=N1
Synonym 2-5-bromo-2-pyridylazo-5-diethylamino phenol,2-5-bromopyridin-2-yl diazenyl-5-diethylamino phenol,bromo-padap,2-5-bromo-2-pyridylazo-5-diethylaminophenol,phenol, 2-5-bromo-2-pyridinyl azo-5-diethylamino,2-4-diethylamino-2-hydroxyphenylazo-5-bromopyridine,hnvcxdavehoibp-vhebqxmusa-n,2-5-bromo-2-pyridylazo-5-diethylamino-phenol,5-diethylamino-2-5-bromo 2-pyridyl diazenyl phenol,e-2-5-bromopyridin-2-yl diazenyl-5-diethylamino phenol
IUPAC Name (6E)-6-[(5-bromopyridin-2-yl)hydrazinylidene]-3-(diethylamino)cyclohexa-2,4-dien-1-one
InChI Key LYVSIKOGJUDRBK-QGOAFFKASA-N
Molecular Formula C15H17BrN4O
4

Ethyl 3-aminocrotonate, 98+%, Thermo Scientific Chemicals

CAS: 626-34-6 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.16 MDL Number: MFCD00008073,MFCD02730138 InChI Key: YPMPTULBFPFSEQ-UHFFFAOYSA-N Synonym: z-ethyl 3-aminobut-2-enoate,ethyl 3-aminocrotonate,ethyl 3-aminobut-2-enoate,ethyl 2z-3-aminobut-2-enoate,2-butenoic acid, 3-amino-, ethyl ester, 2z,ethyl z-3-aminobut-2-enoate,ethyl 3-amino-2-butenoate,.beta.-aminocrotonic acid ethyl ester,2-butenoic acid, 3-amino-, ethyl ester,ethyl .beta.-aminocrotonate PubChem CID: 643756 IUPAC Name: ethyl (Z)-3-aminobut-2-enoate SMILES: CCOC(=O)C=C(C)N

PubChem CID 643756
CAS 626-34-6
Molecular Weight (g/mol) 129.16
MDL Number MFCD00008073,MFCD02730138
SMILES CCOC(=O)C=C(C)N
Synonym z-ethyl 3-aminobut-2-enoate,ethyl 3-aminocrotonate,ethyl 3-aminobut-2-enoate,ethyl 2z-3-aminobut-2-enoate,2-butenoic acid, 3-amino-, ethyl ester, 2z,ethyl z-3-aminobut-2-enoate,ethyl 3-amino-2-butenoate,.beta.-aminocrotonic acid ethyl ester,2-butenoic acid, 3-amino-, ethyl ester,ethyl .beta.-aminocrotonate
IUPAC Name ethyl (Z)-3-aminobut-2-enoate
InChI Key YPMPTULBFPFSEQ-UHFFFAOYSA-N
Molecular Formula C6H11NO2
5

Methyl 3-aminocrotonate, 97%, Thermo Scientific Chemicals

CAS: 14205-39-1 Molecular Formula: C5H9NO2 Molecular Weight (g/mol): 115.13 MDL Number: MFCD00008072,MFCD00008072,MFCD00008072 InChI Key: XKORCTIIRYKLLG-ONEGZZNKSA-N Synonym: methyl 3-aminocrotonate,methyl 3-aminobut-2-enoate,methyl 2z-3-aminobut-2-enoate,z-methyl 3-aminobut-2-enoate,3-aminocrotonic acid methyl ester,methyl beta-aminocrotonate,methyl z-3-aminobut-2-enoate,methyl 2z-3-amino-2-butenoate,beta-aminocrotonic acid methyl ester,3-amino-2-butenoic acid methyl ester PubChem CID: 643918 IUPAC Name: methyl (Z)-3-aminobut-2-enoate SMILES: COC(=O)\C=C(/C)N

PubChem CID 643918
CAS 14205-39-1
Molecular Weight (g/mol) 115.13
MDL Number MFCD00008072,MFCD00008072,MFCD00008072
SMILES COC(=O)\C=C(/C)N
Synonym methyl 3-aminocrotonate,methyl 3-aminobut-2-enoate,methyl 2z-3-aminobut-2-enoate,z-methyl 3-aminobut-2-enoate,3-aminocrotonic acid methyl ester,methyl beta-aminocrotonate,methyl z-3-aminobut-2-enoate,methyl 2z-3-amino-2-butenoate,beta-aminocrotonic acid methyl ester,3-amino-2-butenoic acid methyl ester
IUPAC Name methyl (Z)-3-aminobut-2-enoate
InChI Key XKORCTIIRYKLLG-ONEGZZNKSA-N
Molecular Formula C5H9NO2
6

Ethyl 3-aminocrotonate, 98.5%, Thermo Scientific Chemicals

CAS: 7318-00-5 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.16 MDL Number: MFCD02730138 InChI Key: YPMPTULBFPFSEQ-PLNGDYQASA-N Synonym: z-ethyl 3-aminobut-2-enoate,ethyl 3-aminocrotonate,ethyl 3-aminobut-2-enoate,ethyl 2z-3-aminobut-2-enoate,2-butenoic acid, 3-amino-, ethyl ester, 2z,ethyl z-3-aminobut-2-enoate,ethyl 3-amino-2-butenoate,.beta.-aminocrotonic acid ethyl ester,2-butenoic acid, 3-amino-, ethyl ester,ethyl .beta.-aminocrotonate PubChem CID: 643756 IUPAC Name: ethyl (Z)-3-aminobut-2-enoate SMILES: CCOC(=O)C=C(C)N

PubChem CID 643756
CAS 7318-00-5
Molecular Weight (g/mol) 129.16
MDL Number MFCD02730138
SMILES CCOC(=O)C=C(C)N
Synonym z-ethyl 3-aminobut-2-enoate,ethyl 3-aminocrotonate,ethyl 3-aminobut-2-enoate,ethyl 2z-3-aminobut-2-enoate,2-butenoic acid, 3-amino-, ethyl ester, 2z,ethyl z-3-aminobut-2-enoate,ethyl 3-amino-2-butenoate,.beta.-aminocrotonic acid ethyl ester,2-butenoic acid, 3-amino-, ethyl ester,ethyl .beta.-aminocrotonate
IUPAC Name ethyl (Z)-3-aminobut-2-enoate
InChI Key YPMPTULBFPFSEQ-PLNGDYQASA-N
Molecular Formula C6H11NO2
7

Thermo Scientific Chemicals Nifedipine

CAS: 21829-25-4 Molecular Formula: C17H18N2O6 Molecular Weight (g/mol): 346.34 MDL Number: MFCD00057326 InChI Key: HYIMSNHJOBLJNT-UHFFFAOYSA-N Synonym: nifedipine,procardia,adalat,procardia xl,adalat cc,cordipin,corinfar,fenihidine,citilat,oxcord PubChem CID: 4485 ChEBI: CHEBI:7565 IUPAC Name: dimethyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate SMILES: COC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC=C1[N+]([O-])=O)C(=O)OC

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PubChem CID 4485
CAS 21829-25-4
Molecular Weight (g/mol) 346.34
ChEBI CHEBI:7565
MDL Number MFCD00057326
SMILES COC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC=C1[N+]([O-])=O)C(=O)OC
Synonym nifedipine,procardia,adalat,procardia xl,adalat cc,cordipin,corinfar,fenihidine,citilat,oxcord
IUPAC Name dimethyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
InChI Key HYIMSNHJOBLJNT-UHFFFAOYSA-N
Molecular Formula C17H18N2O6
8

1-(1-Cyclohexen-1-yl)pyrrolidine, 97%, Thermo Scientific Chemicals

CAS: 1125-99-1 Molecular Formula: C10H17N Molecular Weight (g/mol): 151.253 MDL Number: MFCD00003163 InChI Key: KTZNVZJECQAMBV-UHFFFAOYSA-N Synonym: 1-pyrrolidino-1-cyclohexene,1-pyrrolidinocyclohexene,1-cyclohex-1-en-1-yl pyrrolidine,pyrrolidine, 1-1-cyclohexen-1-yl,1-1-cyclohexen-1-yl pyrrolidine,1-1-pyrrolidinyl cyclohexene,cyclohexanone pyrrolidine enamine,1-pyrrolidinyl-1-cyclohexene,n-1-cyclohexenyl pyrrolidine,1-1-cyclohexenyl pyrrolidine PubChem CID: 70768 IUPAC Name: 1-(cyclohexen-1-yl)pyrrolidine SMILES: C1CCC(=CC1)N2CCCC2

PubChem CID 70768
CAS 1125-99-1
Molecular Weight (g/mol) 151.253
MDL Number MFCD00003163
SMILES C1CCC(=CC1)N2CCCC2
Synonym 1-pyrrolidino-1-cyclohexene,1-pyrrolidinocyclohexene,1-cyclohex-1-en-1-yl pyrrolidine,pyrrolidine, 1-1-cyclohexen-1-yl,1-1-cyclohexen-1-yl pyrrolidine,1-1-pyrrolidinyl cyclohexene,cyclohexanone pyrrolidine enamine,1-pyrrolidinyl-1-cyclohexene,n-1-cyclohexenyl pyrrolidine,1-1-cyclohexenyl pyrrolidine
IUPAC Name 1-(cyclohexen-1-yl)pyrrolidine
InChI Key KTZNVZJECQAMBV-UHFFFAOYSA-N
Molecular Formula C10H17N
9

trans-2-[trans-2-(1,3,3-Trimethyl-2-indolinylidene)ethylidene]-1-indanone, 96%, Thermo Scientific™

CAS: 53704-23-7 Molecular Formula: C22H21NO Molecular Weight (g/mol): 315.416 MDL Number: MFCD06409584 InChI Key: RMZNRQVMHQVFHH-UHFFFAOYSA-N Synonym: 2e-2-2-2e-1,3,3-trimethylindol-2-ylidene ethylidene-3h-inden-1-one,2e-2-2e-2-1,3,3-trimethyl-1,3-dihydro-2h-indol-2-ylidene ethylidene indan-1-one,e-2-2-e-1,3,3-trimethylindolin-2-ylidene ethylidene-2,3-dihydro-1h-inden-1-one,trans-2-trans-2-1,3,3-trimethyl-2-indolinylidene ethylidene-1-indanone,e-2-e-2-1,3,3-trimethylindolin-2-ylidene ethylidene-2,3-dihydro-1h-inden-1-one,2-2-1,3,3-trimethylindolin-2-ylidene ethylidene-2,3-dihydro-1h-inden-1-one PubChem CID: 53426998 IUPAC Name: 2-[2-(1,3,3-trimethylindol-2-ylidene)ethylidene]-3H-inden-1-one SMILES: CC1(C2=CC=CC=C2N(C1=CC=C3CC4=CC=CC=C4C3=O)C)C

PubChem CID 53426998
CAS 53704-23-7
Molecular Weight (g/mol) 315.416
MDL Number MFCD06409584
SMILES CC1(C2=CC=CC=C2N(C1=CC=C3CC4=CC=CC=C4C3=O)C)C
Synonym 2e-2-2-2e-1,3,3-trimethylindol-2-ylidene ethylidene-3h-inden-1-one,2e-2-2e-2-1,3,3-trimethyl-1,3-dihydro-2h-indol-2-ylidene ethylidene indan-1-one,e-2-2-e-1,3,3-trimethylindolin-2-ylidene ethylidene-2,3-dihydro-1h-inden-1-one,trans-2-trans-2-1,3,3-trimethyl-2-indolinylidene ethylidene-1-indanone,e-2-e-2-1,3,3-trimethylindolin-2-ylidene ethylidene-2,3-dihydro-1h-inden-1-one,2-2-1,3,3-trimethylindolin-2-ylidene ethylidene-2,3-dihydro-1h-inden-1-one
IUPAC Name 2-[2-(1,3,3-trimethylindol-2-ylidene)ethylidene]-3H-inden-1-one
InChI Key RMZNRQVMHQVFHH-UHFFFAOYSA-N
Molecular Formula C22H21NO
10

1-(1-Cyclohexen-1-yl)piperidine, 97%, Thermo Scientific Chemicals

CAS: 2981-10-4 MDL Number: MFCD00014643

CAS 2981-10-4
MDL Number MFCD00014643
11

Methyl 3-aminocrotonate, 97%, Thermo Scientific Chemicals

CAS: 14205-39-1 Molecular Formula: C5H9NO2 Molecular Weight (g/mol): 115.13 MDL Number: MFCD00008072,MFCD00008072,MFCD00008072 InChI Key: XKORCTIIRYKLLG-ONEGZZNKSA-N Synonym: methyl 3-aminocrotonate,methyl 3-aminobut-2-enoate,methyl 2z-3-aminobut-2-enoate,z-methyl 3-aminobut-2-enoate,3-aminocrotonic acid methyl ester,methyl beta-aminocrotonate,methyl z-3-aminobut-2-enoate,methyl 2z-3-amino-2-butenoate,beta-aminocrotonic acid methyl ester,3-amino-2-butenoic acid methyl ester PubChem CID: 643918 IUPAC Name: methyl (Z)-3-aminobut-2-enoate SMILES: COC(=O)\C=C(/C)N

PubChem CID 643918
CAS 14205-39-1
Molecular Weight (g/mol) 115.13
MDL Number MFCD00008072,MFCD00008072,MFCD00008072
SMILES COC(=O)\C=C(/C)N
Synonym methyl 3-aminocrotonate,methyl 3-aminobut-2-enoate,methyl 2z-3-aminobut-2-enoate,z-methyl 3-aminobut-2-enoate,3-aminocrotonic acid methyl ester,methyl beta-aminocrotonate,methyl z-3-aminobut-2-enoate,methyl 2z-3-amino-2-butenoate,beta-aminocrotonic acid methyl ester,3-amino-2-butenoic acid methyl ester
IUPAC Name methyl (Z)-3-aminobut-2-enoate
InChI Key XKORCTIIRYKLLG-ONEGZZNKSA-N
Molecular Formula C5H9NO2
12

Diaminomaleonitrile, 98%, Thermo Scientific Chemicals

CAS: 1187-42-4 Molecular Formula: C4H4N4 Molecular Weight (g/mol): 108.1 MDL Number: MFCD00001870 InChI Key: DPZSNGJNFHWQDC-ARJAWSKDSA-N Synonym: diaminomaleonitrile,2,3-diaminomaleonitrile,hydrogen cyanide tetramer,maleonitrile, diamino,ccris 921,2-butenedinitrile, 2,3-diamino-, 2z,2z-diaminobut-2-enedinitrile,2,3-diamino maleonitrile,2-butenedinitrile, 2,3-diamino-, z,z-2,3-diaminobut-2-enedinitrile PubChem CID: 2723951 IUPAC Name: (Z)-2,3-diaminobut-2-enedinitrile SMILES: C(#N)C(=C(C#N)N)N

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PubChem CID 2723951
CAS 1187-42-4
Molecular Weight (g/mol) 108.1
MDL Number MFCD00001870
SMILES C(#N)C(=C(C#N)N)N
Synonym diaminomaleonitrile,2,3-diaminomaleonitrile,hydrogen cyanide tetramer,maleonitrile, diamino,ccris 921,2-butenedinitrile, 2,3-diamino-, 2z,2z-diaminobut-2-enedinitrile,2,3-diamino maleonitrile,2-butenedinitrile, 2,3-diamino-, z,z-2,3-diaminobut-2-enedinitrile
IUPAC Name (Z)-2,3-diaminobut-2-enedinitrile
InChI Key DPZSNGJNFHWQDC-ARJAWSKDSA-N
Molecular Formula C4H4N4
13

Nimodipine, Thermo Scientific Chemicals

CAS: 66085-59-4 Molecular Formula: C21H26N2O7 Molecular Weight (g/mol): 418.45 MDL Number: MFCD00153848 InChI Key: UIAGMCDKSXEBJQ-UHFFFAOYNA-N Synonym: nimodipine,nimotop,periplum,nimodipino,nimodipinum,nymalize,admon,nimodipinum inn-latin,nimodipino inn-spanish,isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-m-nitrophenyl-3,5-pyridinedicarboxylate PubChem CID: 4497 ChEBI: CHEBI:7575 IUPAC Name: 3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate SMILES: COCCOC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC(=C1)[N+]([O-])=O)C(=O)OC(C)C

PubChem CID 4497
CAS 66085-59-4
Molecular Weight (g/mol) 418.45
ChEBI CHEBI:7575
MDL Number MFCD00153848
SMILES COCCOC(=O)C1=C(C)NC(C)=C(C1C1=CC=CC(=C1)[N+]([O-])=O)C(=O)OC(C)C
Synonym nimodipine,nimotop,periplum,nimodipino,nimodipinum,nymalize,admon,nimodipinum inn-latin,nimodipino inn-spanish,isopropyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-m-nitrophenyl-3,5-pyridinedicarboxylate
IUPAC Name 3-O-(2-methoxyethyl) 5-O-propan-2-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
InChI Key UIAGMCDKSXEBJQ-UHFFFAOYNA-N
Molecular Formula C21H26N2O7
14

Thermo Scientific Chemicals Cilnidipine, 99%

CAS: 132203-70-4 Molecular Formula: C27H28N2O7 Molecular Weight (g/mol): 492.52 InChI Key: KJEBULYHNRNJTE-DHZHZOJONA-N PubChem CID: 5282138 ChEBI: CHEBI:31399

PubChem CID 5282138
CAS 132203-70-4
Molecular Weight (g/mol) 492.52
ChEBI CHEBI:31399
InChI Key KJEBULYHNRNJTE-DHZHZOJONA-N
Molecular Formula C27H28N2O7
15

Thermo Scientific Chemicals Potassium indigotrisulfonate

CAS: 67627-18-3 Molecular Formula: C16H7K3N2O11S3 Molecular Weight (g/mol): 616.71 MDL Number: MFCD00013160 InChI Key: XOSMXDUITYWYGR-JRYLAINFSA-K Synonym: potassium indigotrisulfonate,indigotrisulfonic acid tripotassium salt,indigotrisulfonate potassium salt,indigotrisulfonic acid potassium salt,unii-5zza8n0abt,5zza8n0abt,tripotassium indigotrisulfonate,tri-potassium indigotrisulfonate,tripotassium indigo-5,5',7-trisulfonate,tri-potassium indigo-5,5',7-trisulfonate PubChem CID: 6364606 IUPAC Name: tripotassium;(2E)-3-oxo-2-(3-oxo-5-sulfonato-1H-indol-2-ylidene)-1H-indole-5,7-disulfonate SMILES: [K+].[K+].[K+].[O-]S(=O)(=O)C1=CC=C2N\C(C(=O)C2=C1)=C1/NC2=C(C=C(C=C2S([O-])(=O)=O)S([O-])(=O)=O)C1=O

PubChem CID 6364606
CAS 67627-18-3
Molecular Weight (g/mol) 616.71
MDL Number MFCD00013160
SMILES [K+].[K+].[K+].[O-]S(=O)(=O)C1=CC=C2N\C(C(=O)C2=C1)=C1/NC2=C(C=C(C=C2S([O-])(=O)=O)S([O-])(=O)=O)C1=O
Synonym potassium indigotrisulfonate,indigotrisulfonic acid tripotassium salt,indigotrisulfonate potassium salt,indigotrisulfonic acid potassium salt,unii-5zza8n0abt,5zza8n0abt,tripotassium indigotrisulfonate,tri-potassium indigotrisulfonate,tripotassium indigo-5,5',7-trisulfonate,tri-potassium indigo-5,5',7-trisulfonate
IUPAC Name tripotassium;(2E)-3-oxo-2-(3-oxo-5-sulfonato-1H-indol-2-ylidene)-1H-indole-5,7-disulfonate
InChI Key XOSMXDUITYWYGR-JRYLAINFSA-K
Molecular Formula C16H7K3N2O11S3