ethanedioic acid; N-ethyl-N-(phenylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine-4-carboxamide

Systemtic Name: ethanedioic acid; N-ethyl-N-(phenylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: N-benzyl-N-ethyl-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine-4-carboxamide; oxalic acid CAS Name: N-ethyl-N-(phenylmethyl)-1-[(2,3,4-trimethoxyphenyl)methyl]-4-piperidinecarboxamide; oxalic acid IUPAC Name: N-benzyl-N-ethyl-1-[(2,3,4-trimethoxyphenyl)methyl]piperidine-4-carboxamide; oxalic acid Traditional Name: N-benzyl-N-ethyl-1-(2,3,4-trimethoxybenzyl)isonipecotamide; oxalic acid Formula: C27H36N2O8 MolecularWeight: 516.58334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H34N2O4.C2H2O4/c1-5-27(17-19-9-7-6-8-10-19)25(28)20-13-15-26(16-14-20)18-21-11-12-22(29-2)24(31-4)23(21)30-3;3-1(4)2(5)6/h6-12,20H,5,13-18H2,1-4H3;(H,3,4)(H,5,6)