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

Systemtic Name: ethanedioic acid; 1-[(3-ethoxy-2-oxidanyl-phenyl)methyl]-N-(1-phenylethyl)piperidine-4-carboxamide Openeye Name: 1-[(3-ethoxy-2-hydroxy-phenyl)methyl]-N-(1-phenylethyl)piperidine-4-carboxamide; oxalic acid CAS Name: 1-[(3-ethoxy-2-hydroxyphenyl)methyl]-N-(1-phenylethyl)-4-piperidinecarboxamide; oxalic acid IUPAC Name: 1-[(3-ethoxy-2-hydroxyphenyl)methyl]-N-(1-phenylethyl)piperidine-4-carboxamide; oxalic acid Traditional Name: 1-(3-ethoxy-2-hydroxy-benzyl)-N-(1-phenylethyl)isonipecotamide; oxalic acid Formula: C25H32N2O7 MolecularWeight: 472.53078

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1O)CN2CCC(CC2)C(=O)NC(C)C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC1=CC=CC(=C1O)CN2CCC(CC2)C(=O)NC(C)C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H30N2O3.C2H2O4/c1-3-28-21-11-7-10-20(22(21)26)16-25-14-12-19(13-15-25)23(27)24-17(2)18-8-5-4-6-9-18;3-1(4)2(5)6/h4-11,17,19,26H,3,12-16H2,1-2H3,(H,24,27);(H,3,4)(H,5,6)