ethanedioic acid; 2-(4-methylphenyl)ethyl 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate

Systemtic Name: ethanedioic acid; 2-(4-methylphenyl)ethyl 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate Openeye Name: oxalic acid; 2-(p-tolyl)ethyl 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate CAS Name: 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylic acid 2-(4-methylphenyl)ethyl ester; oxalic acid IUPAC Name: 2-(4-methylphenyl)ethyl 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylate; oxalic acid Traditional Name: 1-ethyl-4-phenyl-3,6-dihydro-2H-pyridine-5-carboxylic acid 2-(p-tolyl)ethyl ester; oxalic acid Formula: C25H29NO6 MolecularWeight: 439.50086

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC(=C(C1)C(=O)OCCC2=CC=C(C=C2)C)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCC(=C(C1)C(=O)OCCC2=CC=C(C=C2)C)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H27NO2.C2H2O4/c1-3-24-15-13-21(20-7-5-4-6-8-20)22(17-24)23(25)26-16-14-19-11-9-18(2)10-12-19;3-1(4)2(5)6/h4-12H,3,13-17H2,1-2H3;(H,3,4)(H,5,6)