O3,O5-diethyl O4-[(4-methylphenyl)methyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate

Systemtic Name: O3,O5-diethyl O4-[(4-methylphenyl)methyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate Openeye Name: O3,O5-diethyl O4-(p-tolylmethyl) 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate CAS Name: 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylic acid O3,O5-diethyl ester O4-[(4-methylphenyl)methyl] ester IUPAC Name: 3-O,5-O-diethyl 4-O-[(4-methylphenyl)methyl] 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylate Traditional Name: 2,6-dimethyl-1,4-dihydropyridine-3,4,5-tricarboxylic acid O3,O5-diethyl ester O4-(4-methylbenzyl) ester Formula: C22H27NO6 MolecularWeight: 401.45288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C(=O)OCC2=CC=C(C=C2)C)C(=O)OCC)C)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C(=O)OCC2=CC=C(C=C2)C)C(=O)OCC)C)C

InChI

InChI=1S/C22H27NO6/c1-6-27-20(24)17-14(4)23-15(5)18(21(25)28-7-2)19(17)22(26)29-12-16-10-8-13(3)9-11-16/h8-11,19,23H,6-7,12H2,1-5H3