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

Systemtic Name: tert-butyl 5-cyano-2-methyl-4-(4-methylphenyl)-6-(2-methylpropyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: tert-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 tert-butyl ester IUPAC Name: tert-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 tert-butyl ester Formula: C23H30N2O2 MolecularWeight: 366.4965

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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