butyl 5-cyano-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: butyl 5-cyano-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: butyl 5-cyano-6-isobutyl-2-methyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)-1,4-dihydropyridine-3-carboxylic acid butyl ester IUPAC Name: butyl 5-cyano-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-6-isobutyl-2-methyl-4-(p-tolyl)-1,4-dihydropyridine-3-carboxylic acid butyl ester Formula: C23H30N2O2 MolecularWeight: 366.4965

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C)C#N)CC(C)C)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC(=C(C1C2=CC=C(C=C2)C)C#N)CC(C)C)C

InChI

InChI=1S/C23H30N2O2/c1-6-7-12-27-23(26)21-17(5)25-20(13-15(2)3)19(14-24)22(21)18-10-8-16(4)9-11-18/h8-11,15,22,25H,6-7,12-13H2,1-5H3