ethanedioic acid; N-ethyl-1-[(3-phenylmethoxyphenyl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: ethanedioic acid; N-ethyl-1-[(3-phenylmethoxyphenyl)methyl]-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[(3-benzyloxyphenyl)methyl]-N-ethyl-piperidine-4-carboxamide; oxalic acid CAS Name: N-ethyl-1-[(3-phenylmethoxyphenyl)methyl]-N-(phenylmethyl)-4-piperidinecarboxamide; oxalic acid IUPAC Name: N-benzyl-N-ethyl-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide; oxalic acid Traditional Name: 1-(3-benzoxybenzyl)-N-benzyl-N-ethyl-isonipecotamide; oxalic acid Formula: C31H36N2O6 MolecularWeight: 532.62734

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)CC3=CC(=CC=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC1=CC=CC=C1)C(=O)C2CCN(CC2)CC3=CC(=CC=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C29H34N2O2.C2H2O4/c1-2-31(22-24-10-5-3-6-11-24)29(32)27-16-18-30(19-17-27)21-26-14-9-15-28(20-26)33-23-25-12-7-4-8-13-25;3-1(4)2(5)6/h3-15,20,27H,2,16-19,21-23H2,1H3;(H,3,4)(H,5,6)