2-methyl-4-(2-methylphenyl)-5-nitro-6-thiophen-2-yl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 2-methyl-4-(2-methylphenyl)-5-nitro-6-thiophen-2-yl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 2-methyl-5-nitro-4-(o-tolyl)-6-(2-thienyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 2-methyl-4-(2-methylphenyl)-5-nitro-6-thiophen-2-yl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 2-methyl-4-(2-methylphenyl)-5-nitro-6-thiophen-2-yl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 2-methyl-5-nitro-4-(o-tolyl)-6-(2-thienyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(NC(=C2[N+](=O)[O-])C3=CC=CS3)C)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2C(=C(NC(=C2[N+](=O)[O-])C3=CC=CS3)C)C(=O)O

InChI

InChI=1S/C18H16N2O4S/c1-10-6-3-4-7-12(10)15-14(18(21)22)11(2)19-16(17(15)20(23)24)13-8-5-9-25-13/h3-9,15,19H,1-2H3,(H,21,22)