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

Systemtic Name: ethanedioic acid; N-(3-ethoxypropyl)-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide Openeye Name: 1-[(3-benzyloxyphenyl)methyl]-N-(3-ethoxypropyl)piperidine-4-carboxamide; oxalic acid CAS Name: N-(3-ethoxypropyl)-1-[(3-phenylmethoxyphenyl)methyl]-4-piperidinecarboxamide; oxalic acid IUPAC Name: N-(3-ethoxypropyl)-1-[(3-phenylmethoxyphenyl)methyl]piperidine-4-carboxamide; oxalic acid Traditional Name: 1-(3-benzoxybenzyl)-N-(3-ethoxypropyl)isonipecotamide; oxalic acid Formula: C27H36N2O7 MolecularWeight: 500.58394

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1CCN(CC1)CC2=CC(=CC=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCOCCCNC(=O)C1CCN(CC1)CC2=CC(=CC=C2)OCC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H34N2O3.C2H2O4/c1-2-29-17-7-14-26-25(28)23-12-15-27(16-13-23)19-22-10-6-11-24(18-22)30-20-21-8-4-3-5-9-21;3-1(4)2(5)6/h3-6,8-11,18,23H,2,7,12-17,19-20H2,1H3,(H,26,28);(H,3,4)(H,5,6)