6-cyano-5-methoxycarbonyl-2-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 6-cyano-5-methoxycarbonyl-2-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 6-cyano-5-methoxycarbonyl-2-methyl-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylic acid CAS Name: 6-cyano-5-methoxycarbonyl-2-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 6-cyano-5-methoxycarbonyl-2-methyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 5-carbomethoxy-6-cyano-2-methyl-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylic acid Formula: C17H16N2O4 MolecularWeight: 312.31994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OC)C#N)C)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OC)C#N)C)C(=O)O

InChI

InChI=1S/C17H16N2O4/c1-9-6-4-5-7-11(9)14-13(16(20)21)10(2)19-12(8-18)15(14)17(22)23-3/h4-7,14,19H,1-3H3,(H,20,21)