dibutyl 4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dibutyl 4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dibutyl 4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dibutyl ester IUPAC Name: dibutyl 4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 4-(2-chlorophenyl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid dibutyl ester Formula: C23H30ClNO4 MolecularWeight: 419.9416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OCCCC)C)C

Isomeric SMILES

CCCCOC(=O)C1=C(NC(=C(C1C2=CC=CC=C2Cl)C(=O)OCCCC)C)C

InChI

InChI=1S/C23H30ClNO4/c1-5-7-13-28-22(26)19-15(3)25-16(4)20(23(27)29-14-8-6-2)21(19)17-11-9-10-12-18(17)24/h9-12,21,25H,5-8,13-14H2,1-4H3