ethanedioic acid; 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-(3-methylbutyl)piperidine-4-carboxamide

Systemtic Name: ethanedioic acid; 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-N-(3-methylbutyl)piperidine-4-carboxamide Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-N-isopentyl-piperidine-4-carboxamide; oxalic acid CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-(3-methylbutyl)-4-piperidinecarboxamide; oxalic acid IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-N-(3-methylbutyl)piperidine-4-carboxamide; oxalic acid Traditional Name: 1-(4-benzoxy-3-methoxy-benzyl)-N-isoamyl-isonipecotamide; oxalic acid Formula: C28H38N2O7 MolecularWeight: 514.61052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H36N2O3.C2H2O4/c1-20(2)11-14-27-26(29)23-12-15-28(16-13-23)18-22-9-10-24(25(17-22)30-3)31-19-21-7-5-4-6-8-21;3-1(4)2(5)6/h4-10,17,20,23H,11-16,18-19H2,1-3H3,(H,27,29);(H,3,4)(H,5,6)