methyl 6-azanyl-1-benzamido-3-cyano-4-(4-methylphenyl)-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate

Systemtic Name: methyl 6-azanyl-1-benzamido-3-cyano-4-(4-methylphenyl)-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate Openeye Name: methyl 6-amino-1-benzamido-3-cyano-2-oxo-4-(p-tolyl)-3,4-dihydropyridine-5-carboxylate CAS Name: 6-amino-1-benzamido-3-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydropyridine-5-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-1-benzamido-3-cyano-4-(4-methylphenyl)-2-oxo-3,4-dihydropyridine-5-carboxylate Traditional Name: 6-amino-1-benzamido-3-cyano-2-keto-4-(p-tolyl)-3,4-dihydropyridine-5-carboxylic acid methyl ester Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C(C(=O)N(C(=C2C(=O)OC)N)NC(=O)C3=CC=CC=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C2C(C(=O)N(C(=C2C(=O)OC)N)NC(=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C22H20N4O4/c1-13-8-10-14(11-9-13)17-16(12-23)21(28)26(19(24)18(17)22(29)30-2)25-20(27)15-6-4-3-5-7-15/h3-11,16-17H,24H2,1-2H3,(H,25,27)