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

Systemtic Name: 2-methylpropyl 1-[(3-cyanophenyl)methyl]-4-(4-methoxyphenyl)-6-methyl-2-oxidanylidene-3,4-dihydropyridine-5-carboxylate Openeye Name: isobutyl 1-[(3-cyanophenyl)methyl]-4-(4-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylate CAS Name: 1-[(3-cyanophenyl)methyl]-4-(4-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 1-[(3-cyanophenyl)methyl]-4-(4-methoxyphenyl)-6-methyl-2-oxo-3,4-dihydropyridine-5-carboxylate Traditional Name: 1-(3-cyanobenzyl)-2-keto-4-(4-methoxyphenyl)-6-methyl-3,4-dihydropyridine-5-carboxylic acid isobutyl ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CC(=O)N1CC2=CC=CC(=C2)C#N)C3=CC=C(C=C3)OC)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(CC(=O)N1CC2=CC=CC(=C2)C#N)C3=CC=C(C=C3)OC)C(=O)OCC(C)C

InChI

InChI=1S/C26H28N2O4/c1-17(2)16-32-26(30)25-18(3)28(15-20-7-5-6-19(12-20)14-27)24(29)13-23(25)21-8-10-22(31-4)11-9-21/h5-12,17,23H,13,15-16H2,1-4H3