ethanedioic acid; 1-[[4-[(4-phenylmethoxyphenoxy)methyl]phenyl]methyl]piperidine

Systemtic Name: ethanedioic acid; 1-[[4-[(4-phenylmethoxyphenoxy)methyl]phenyl]methyl]piperidine Openeye Name: 1-[[4-[(4-benzyloxyphenoxy)methyl]phenyl]methyl]piperidine; oxalic acid CAS Name: oxalic acid; 1-[[4-[(4-phenylmethoxyphenoxy)methyl]phenyl]methyl]piperidine IUPAC Name: oxalic acid; 1-[[4-[(4-phenylmethoxyphenoxy)methyl]phenyl]methyl]piperidine Traditional Name: 1-[4-[(4-benzoxyphenoxy)methyl]benzyl]piperidine; oxalic acid Formula: C28H31NO6 MolecularWeight: 477.54884

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)COC3=CC=C(C=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)COC3=CC=C(C=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C26H29NO2.C2H2O4/c1-3-7-23(8-4-1)20-28-25-13-15-26(16-14-25)29-21-24-11-9-22(10-12-24)19-27-17-5-2-6-18-27;3-1(4)2(5)6/h1,3-4,7-16H,2,5-6,17-21H2;(H,3,4)(H,5,6)