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5,5',7-Indigotrisulfonic Acid Potassium Salt, Spectrum™ Chemical
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CAS: 67627-18-3
| CAS | 67627-18-3 |
|---|
Indigotrisulfonic Acid Potassium Salt 55.0+%, TCI America™
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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 (Z)-3,3'-dioxo-1H,1'H,3H,3'H-[2,2'-biindolylidene]-5,5',7-trisulfonate 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 (Z)-3,3'-dioxo-1H,1'H,3H,3'H-[2,2'-biindolylidene]-5,5',7-trisulfonate |
| InChI Key | XOSMXDUITYWYGR-JRYLAINFSA-K |
| Molecular Formula | C16H7K3N2O11S3 |
5,5'-Indigodisulfonic Acid, Disodium Salt, BAKER™, J.T. Baker™
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 IUPAC Name: disodium (E)-3,3'-dioxo-1H,1'H,3H,3'H-[2,2'-biindolylidene]-5,5'-disulfonate 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
| 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 |
| IUPAC Name | disodium (E)-3,3'-dioxo-1H,1'H,3H,3'H-[2,2'-biindolylidene]-5,5'-disulfonate |
| InChI Key | KHLVKKOJDHCJMG-QDBORUFSSA-L |
| Molecular Formula | C16H8N2Na2O8S2 |
Sigma Aldrich 4-(N,N-dimethylamino)phenylboronic acid, pinacol ester
MilliporeSigma Sigma Organics products encompass a wide range of quality reagents, solvents, catalysts, and building blocks for organic synthesis. From benchtop discovery to process development and scale-up, Sigma Organics solutions are built to meet the needs of synthetic chemists.
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Indigo Carmine 95.0+%, TCI America™
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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 IUPAC Name: disodium (E)-3,3'-dioxo-1H,1'H,3H,3'H-[2,2'-biindolylidene]-5,5'-disulfonate 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
| 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 |
| IUPAC Name | disodium (E)-3,3'-dioxo-1H,1'H,3H,3'H-[2,2'-biindolylidene]-5,5'-disulfonate |
| InChI Key | KHLVKKOJDHCJMG-QDBORUFSSA-L |
| Molecular Formula | C16H8N2Na2O8S2 |
Ethyl 3-Amino-2-butenoate 98.0+%, TCI America™
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CAS: 7318-00-5 Molecular Formula: C6H11NO2 Molecular Weight (g/mol): 129.159 MDL Number: MFCD00008073 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) | 129.159 |
| MDL Number | MFCD00008073 |
| 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 |
Ethyl 3-Amino-4,4,4-trifluorocrotonate 97.0+%, TCI America™
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CAS: 372-29-2 Molecular Formula: C6H8F3NO2 Molecular Weight (g/mol): 183.13 MDL Number: MFCD00068195 InChI Key: NXVKRKUGIINGHD-ONEGZZNKSA-N PubChem CID: 10899311 IUPAC Name: ethyl (E)-3-amino-4,4,4-trifluorobut-2-enoate SMILES: CCOC(=O)C=C(C(F)(F)F)N
| PubChem CID | 10899311 |
|---|---|
| CAS | 372-29-2 |
| Molecular Weight (g/mol) | 183.13 |
| MDL Number | MFCD00068195 |
| SMILES | CCOC(=O)C=C(C(F)(F)F)N |
| IUPAC Name | ethyl (E)-3-amino-4,4,4-trifluorobut-2-enoate |
| InChI Key | NXVKRKUGIINGHD-ONEGZZNKSA-N |
| Molecular Formula | C6H8F3NO2 |
Isopropyl 3-Aminocrotonate 98.0+%, TCI America™
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CAS: 14205-46-0 Molecular Formula: C7H13NO2 Molecular Weight (g/mol): 143.186 MDL Number: MFCD00134272 InChI Key: YCKAGGHNUHZKCL-XQRVVYSFSA-N Synonym: 3-Aminocrotonic Acid Isopropyl Ester, Isopropyl 3-Amino-2-butenoate, 3-Amino-2-butenoic Acid Isopropyl Ester PubChem CID: 11137274 IUPAC Name: propan-2-yl (Z)-3-aminobut-2-enoate SMILES: CC(C)OC(=O)C=C(C)N
| PubChem CID | 11137274 |
|---|---|
| CAS | 14205-46-0 |
| Molecular Weight (g/mol) | 143.186 |
| MDL Number | MFCD00134272 |
| SMILES | CC(C)OC(=O)C=C(C)N |
| Synonym | 3-Aminocrotonic Acid Isopropyl Ester, Isopropyl 3-Amino-2-butenoate, 3-Amino-2-butenoic Acid Isopropyl Ester |
| IUPAC Name | propan-2-yl (Z)-3-aminobut-2-enoate |
| InChI Key | YCKAGGHNUHZKCL-XQRVVYSFSA-N |
| Molecular Formula | C7H13NO2 |
Methyl 3-Aminocrotonate 98.0+%, TCI America™
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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 (2E)-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 (2E)-3-aminobut-2-enoate |
| InChI Key | XKORCTIIRYKLLG-ONEGZZNKSA-N |
| Molecular Formula | C5H9NO2 |
Nilvadipine 95.0+%, TCI America™
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CAS: 75530-68-6 Molecular Formula: C19H19N3O6 Molecular Weight (g/mol): 385.38 MDL Number: MFCD00867065 InChI Key: FAIIFDPAEUKBEP-UHFFFAOYNA-N Synonym: 2-Cyano-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid 5-Isopropyl 3-Methyl Ester, 5-Isopropyl 3-Methyl 2-Cyano-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate PubChem CID: 4494 IUPAC Name: 3-methyl 5-propan-2-yl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate SMILES: COC(=O)C1=C(NC(C)=C(C1C1=CC=CC(=C1)[N+]([O-])=O)C(=O)OC(C)C)C#N
| PubChem CID | 4494 |
|---|---|
| CAS | 75530-68-6 |
| Molecular Weight (g/mol) | 385.38 |
| MDL Number | MFCD00867065 |
| SMILES | COC(=O)C1=C(NC(C)=C(C1C1=CC=CC(=C1)[N+]([O-])=O)C(=O)OC(C)C)C#N |
| Synonym | 2-Cyano-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid 5-Isopropyl 3-Methyl Ester, 5-Isopropyl 3-Methyl 2-Cyano-1,4-dihydro-6-methyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate |
| IUPAC Name | 3-methyl 5-propan-2-yl 2-cyano-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| InChI Key | FAIIFDPAEUKBEP-UHFFFAOYNA-N |
| Molecular Formula | C19H19N3O6 |
Monomethyl 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylate 98.0+%, TCI America™
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CAS: 74936-72-4 Molecular Formula: C16H16N2O6 Molecular Weight (g/mol): 332.312 MDL Number: MFCD00475478 InChI Key: JPXPPUOCSLMCHK-UHFFFAOYSA-N Synonym: 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid Monomethyl Ester PubChem CID: 173322 IUPAC Name: 5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid SMILES: CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O
| PubChem CID | 173322 |
|---|---|
| CAS | 74936-72-4 |
| Molecular Weight (g/mol) | 332.312 |
| MDL Number | MFCD00475478 |
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O |
| Synonym | 1,4-Dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic Acid Monomethyl Ester |
| IUPAC Name | 5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3-carboxylic acid |
| InChI Key | JPXPPUOCSLMCHK-UHFFFAOYSA-N |
| Molecular Formula | C16H16N2O6 |
Cilnidipine 98.0+%, TCI America™
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CAS: 132203-70-4 Molecular Formula: C27H28N2O7 Molecular Weight (g/mol): 492.528 MDL Number: MFCD00865853 InChI Key: KJEBULYHNRNJTE-DHZHZOJOSA-N Synonym: cilnidipine,cinalong,atelec,siscard,cilnidipine inn,cinaldipine,3-cinnamyl 5-2-methoxyethyl 2,6-dimethyl-4-3-nitrophenyl-1,4-dihydropyridine-3,5-dicarboxylate,atelec tn,+--e-cinnamyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-m-nitrophenyl-3,5-pyridinedicarboxylate,1,4-dihydro-2,6-dimethyl-4-3-nitrophenyl-3,5-pyridinedicarboxylic acid 2-methoxyethyl 2e-3-phenyl-2-propenyl ester PubChem CID: 5282138 ChEBI: CHEBI:31399 IUPAC Name: 3-O-(2-methoxyethyl) 5-O-[(E)-3-phenylprop-2-enyl] 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate SMILES: CC1=C(C(C(=C(N1)C)C(=O)OCC=CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCOC
| PubChem CID | 5282138 |
|---|---|
| CAS | 132203-70-4 |
| Molecular Weight (g/mol) | 492.528 |
| ChEBI | CHEBI:31399 |
| MDL Number | MFCD00865853 |
| SMILES | CC1=C(C(C(=C(N1)C)C(=O)OCC=CC2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OCCOC |
| Synonym | cilnidipine,cinalong,atelec,siscard,cilnidipine inn,cinaldipine,3-cinnamyl 5-2-methoxyethyl 2,6-dimethyl-4-3-nitrophenyl-1,4-dihydropyridine-3,5-dicarboxylate,atelec tn,+--e-cinnamyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-m-nitrophenyl-3,5-pyridinedicarboxylate,1,4-dihydro-2,6-dimethyl-4-3-nitrophenyl-3,5-pyridinedicarboxylic acid 2-methoxyethyl 2e-3-phenyl-2-propenyl ester |
| IUPAC Name | 3-O-(2-methoxyethyl) 5-O-[(E)-3-phenylprop-2-enyl] 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| InChI Key | KJEBULYHNRNJTE-DHZHZOJOSA-N |
| Molecular Formula | C27H28N2O7 |
Di-tert-butyl 1,4-Dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate 98.0+%, TCI America™
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CAS: 55536-71-5 Molecular Formula: C17H27NO4 Molecular Weight (g/mol): 309.41 MDL Number: MFCD01882057 InChI Key: WSWDAKKWVAVVAI-UHFFFAOYSA-N Synonym: 1,4-Dihydro-2,6-dimethyl-3,5-pyridinedicarboxylic Acid Di-tert-butyl Ester PubChem CID: 4455240 IUPAC Name: 3,5-di-tert-butyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate SMILES: CC1=C(CC(C(=O)OC(C)(C)C)=C(C)N1)C(=O)OC(C)(C)C
| PubChem CID | 4455240 |
|---|---|
| CAS | 55536-71-5 |
| Molecular Weight (g/mol) | 309.41 |
| MDL Number | MFCD01882057 |
| SMILES | CC1=C(CC(C(=O)OC(C)(C)C)=C(C)N1)C(=O)OC(C)(C)C |
| Synonym | 1,4-Dihydro-2,6-dimethyl-3,5-pyridinedicarboxylic Acid Di-tert-butyl Ester |
| IUPAC Name | 3,5-di-tert-butyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| InChI Key | WSWDAKKWVAVVAI-UHFFFAOYSA-N |
| Molecular Formula | C17H27NO4 |
Diethyl 1,4-Dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate 98.0+%, TCI America™
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CAS: 1149-23-1 Molecular Formula: C13H19NO4 Molecular Weight (g/mol): 253.298 MDL Number: MFCD00005951 InChI Key: LJXTYJXBORAIHX-UHFFFAOYSA-N Synonym: diludine,diethyl 1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate,hantzsch ester,ethidine,etidin,diethone,hantzsch's dihydropyridine,diethyl 2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate,diludin,3,5-pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-, diethyl ester PubChem CID: 70849 IUPAC Name: diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate SMILES: CCOC(=O)C1=C(NC(=C(C1)C(=O)OCC)C)C
| PubChem CID | 70849 |
|---|---|
| CAS | 1149-23-1 |
| Molecular Weight (g/mol) | 253.298 |
| MDL Number | MFCD00005951 |
| SMILES | CCOC(=O)C1=C(NC(=C(C1)C(=O)OCC)C)C |
| Synonym | diludine,diethyl 1,4-dihydro-2,6-dimethyl-3,5-pyridinedicarboxylate,hantzsch ester,ethidine,etidin,diethone,hantzsch's dihydropyridine,diethyl 2,6-dimethyl-1,4-dihydro-3,5-pyridinedicarboxylate,diludin,3,5-pyridinedicarboxylic acid, 1,4-dihydro-2,6-dimethyl-, diethyl ester |
| IUPAC Name | diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate |
| InChI Key | LJXTYJXBORAIHX-UHFFFAOYSA-N |
| Molecular Formula | C13H19NO4 |
Nifedipine 98.0+%, TCI America™
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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: 3,5-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
| 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 | 3,5-dimethyl 2,6-dimethyl-4-(2-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate |
| InChI Key | HYIMSNHJOBLJNT-UHFFFAOYSA-N |
| Molecular Formula | C17H18N2O6 |