ethanedioic acid; 1-[(3-methoxy-2-oxidanyl-phenyl)methyl]-N-(1-phenylethyl)piperidine-4-carboxamide

Systemtic Name: ethanedioic acid; 1-[(3-methoxy-2-oxidanyl-phenyl)methyl]-N-(1-phenylethyl)piperidine-4-carboxamide Openeye Name: 1-[(2-hydroxy-3-methoxy-phenyl)methyl]-N-(1-phenylethyl)piperidine-4-carboxamide; oxalic acid CAS Name: 1-[(2-hydroxy-3-methoxyphenyl)methyl]-N-(1-phenylethyl)-4-piperidinecarboxamide; oxalic acid IUPAC Name: 1-[(2-hydroxy-3-methoxyphenyl)methyl]-N-(1-phenylethyl)piperidine-4-carboxamide; oxalic acid Traditional Name: 1-(2-hydroxy-3-methoxy-benzyl)-N-(1-phenylethyl)isonipecotamide; oxalic acid Formula: C24H30N2O7 MolecularWeight: 458.5042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O3.C2H2O4/c1-16(17-7-4-3-5-8-17)23-22(26)18-11-13-24(14-12-18)15-19-9-6-10-20(27-2)21(19)25;3-1(4)2(5)6/h3-10,16,18,25H,11-15H2,1-2H3,(H,23,26);(H,3,4)(H,5,6)