ethanedioic acid; 3-[[4-[2-(2-methoxy-5-methyl-phenyl)ethyl]piperidin-1-yl]methyl]-1H-pyridin-2-one

Systemtic Name: ethanedioic acid; 3-[[4-[2-(2-methoxy-5-methyl-phenyl)ethyl]piperidin-1-yl]methyl]-1H-pyridin-2-one Openeye Name: 3-[[4-[2-(2-methoxy-5-methyl-phenyl)ethyl]-1-piperidyl]methyl]-1H-pyridin-2-one; oxalic acid CAS Name: 3-[[4-[2-(2-methoxy-5-methylphenyl)ethyl]-1-piperidinyl]methyl]-1H-pyridin-2-one; oxalic acid IUPAC Name: 3-[[4-[2-(2-methoxy-5-methylphenyl)ethyl]piperidin-1-yl]methyl]-1H-pyridin-2-one; oxalic acid Traditional Name: 3-[[4-[2-(2-methoxy-5-methyl-phenyl)ethyl]piperidino]methyl]-2-pyridone; oxalic acid Formula: C23H30N2O6 MolecularWeight: 430.4941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)CCC2CCN(CC2)CC3=CC=CNC3=O.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)CCC2CCN(CC2)CC3=CC=CNC3=O.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H28N2O2.C2H2O4/c1-16-5-8-20(25-2)18(14-16)7-6-17-9-12-23(13-10-17)15-19-4-3-11-22-21(19)24;3-1(4)2(5)6/h3-5,8,11,14,17H,6-7,9-10,12-13,15H2,1-2H3,(H,22,24);(H,3,4)(H,5,6)