(phenylmethyl) 2,6-dimethyl-4-(2-methylphenyl)-5-(phenylcarbonyl)-1,4-dihydropyridine-3-carboxylate

Systemtic Name: (phenylmethyl) 2,6-dimethyl-4-(2-methylphenyl)-5-(phenylcarbonyl)-1,4-dihydropyridine-3-carboxylate Openeye Name: benzyl 5-benzoyl-2,6-dimethyl-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 5-benzoyl-2,6-dimethyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-benzoyl-2,6-dimethyl-4-(2-methylphenyl)-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-benzoyl-2,6-dimethyl-4-(o-tolyl)-1,4-dihydropyridine-3-carboxylic acid benzyl ester Formula: C29H27NO3 MolecularWeight: 437.52958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OCC3=CC=CC=C3)C)C)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)OCC3=CC=CC=C3)C)C)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C29H27NO3/c1-19-12-10-11-17-24(19)27-25(28(31)23-15-8-5-9-16-23)20(2)30-21(3)26(27)29(32)33-18-22-13-6-4-7-14-22/h4-17,27,30H,18H2,1-3H3