ethanedioic acid; [1-[(3-hydroxyphenyl)methyl]piperidin-4-yl] N-(2-phenylphenyl)carbamate

Systemtic Name: ethanedioic acid; [1-[(3-hydroxyphenyl)methyl]piperidin-4-yl] N-(2-phenylphenyl)carbamate Openeye Name: [1-[(3-hydroxyphenyl)methyl]-4-piperidyl] N-(2-phenylphenyl)carbamate; oxalic acid CAS Name: oxalic acid; N-(2-phenylphenyl)carbamic acid [1-[(3-hydroxyphenyl)methyl]-4-piperidinyl] ester IUPAC Name: [1-[(3-hydroxyphenyl)methyl]piperidin-4-yl] N-(2-phenylphenyl)carbamate; oxalic acid Traditional Name: oxalic acid; N-(2-phenylphenyl)carbamic acid [1-(3-hydroxybenzyl)-4-piperidyl] ester Formula: C27H28N2O7 MolecularWeight: 492.52042

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1OC(=O)NC2=CC=CC=C2C3=CC=CC=C3)CC4=CC(=CC=C4)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1OC(=O)NC2=CC=CC=C2C3=CC=CC=C3)CC4=CC(=CC=C4)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H26N2O3.C2H2O4/c28-21-10-6-7-19(17-21)18-27-15-13-22(14-16-27)30-25(29)26-24-12-5-4-11-23(24)20-8-2-1-3-9-20;3-1(4)2(5)6/h1-12,17,22,28H,13-16,18H2,(H,26,29);(H,3,4)(H,5,6)