2-methylpropyl 1-[(3-cyanophenyl)methyl]-4-(2,5-dimethylphenyl)-6-methyl-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate

Systemtic Name: 2-methylpropyl 1-[(3-cyanophenyl)methyl]-4-(2,5-dimethylphenyl)-6-methyl-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate Openeye Name: isobutyl 1-[(3-cyanophenyl)methyl]-4-(2,5-dimethylphenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylate CAS Name: 1-[(3-cyanophenyl)methyl]-4-(2,5-dimethylphenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 1-[(3-cyanophenyl)methyl]-4-(2,5-dimethylphenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylate Traditional Name: 1-(3-cyanobenzyl)-4-(2,5-dimethylphenyl)-2-keto-6-methyl-3,4-dihydropyridine-5-carboxylic acid isobutyl ester Formula: C27H30N2O3 MolecularWeight: 430.5387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2CC(=O)N(C(=C2C(=O)OCC(C)C)C)CC3=CC=CC(=C3)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2CC(=O)N(C(=C2C(=O)OCC(C)C)C)CC3=CC=CC(=C3)C#N

InChI

InChI=1S/C27H30N2O3/c1-17(2)16-32-27(31)26-20(5)29(15-22-8-6-7-21(12-22)14-28)25(30)13-24(26)23-11-18(3)9-10-19(23)4/h6-12,17,24H,13,15-16H2,1-5H3