2-but-3-enyl-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4-thiophen-2-yl-1,3-dihydropyridine-3-carboxylic acid

Systemtic Name: 2-but-3-enyl-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4-thiophen-2-yl-1,3-dihydropyridine-3-carboxylic acid Openeye Name: 2-but-3-enyl-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4-(2-thienyl)-1,3-dihydropyridine-3-carboxylic acid CAS Name: 2-but-3-enyl-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4-thiophen-2-yl-1,3-dihydropyridine-3-carboxylic acid IUPAC Name: 2-but-3-enyl-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)-4-thiophen-2-yl-1,3-dihydropyridine-3-carboxylic acid Traditional Name: 2-but-3-enyl-5-carbomethoxy-2,6-dimethyl-4-(3-nitrophenyl)-4-(2-thienyl)-1,3-dihydropyridine-3-carboxylic acid Formula: C24H26N2O6S MolecularWeight: 470.53804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(C(N1)(C)CCC=C)C(=O)O)(C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CS3)C(=O)OC

Isomeric SMILES

CC1=C(C(C(C(N1)(C)CCC=C)C(=O)O)(C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C24H26N2O6S/c1-5-6-12-23(3)20(21(27)28)24(18-11-8-13-33-18,19(15(2)25-23)22(29)32-4)16-9-7-10-17(14-16)26(30)31/h5,7-11,13-14,20,25H,1,6,12H2,2-4H3,(H,27,28)