ethanedioic acid; 1-[(3-phenoxyphenyl)methyl]-N-propan-2-yl-piperidine-4-carboxamide

Systemtic Name: ethanedioic acid; 1-[(3-phenoxyphenyl)methyl]-N-propan-2-yl-piperidine-4-carboxamide Openeye Name: N-isopropyl-1-[(3-phenoxyphenyl)methyl]piperidine-4-carboxamide; oxalic acid CAS Name: oxalic acid; 1-[(3-phenoxyphenyl)methyl]-N-propan-2-yl-4-piperidinecarboxamide IUPAC Name: oxalic acid; 1-[(3-phenoxyphenyl)methyl]-N-propan-2-ylpiperidine-4-carboxamide Traditional Name: N-isopropyl-1-(3-phenoxybenzyl)isonipecotamide; oxalic acid Formula: C24H30N2O6 MolecularWeight: 442.5048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1CCN(CC1)CC2=CC(=CC=C2)OC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

CC(C)NC(=O)C1CCN(CC1)CC2=CC(=CC=C2)OC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H28N2O2.C2H2O4/c1-17(2)23-22(25)19-11-13-24(14-12-19)16-18-7-6-10-21(15-18)26-20-8-4-3-5-9-20;3-1(4)2(5)6/h3-10,15,17,19H,11-14,16H2,1-2H3,(H,23,25);(H,3,4)(H,5,6)