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

Systemtic Name: ethanedioic acid; 1-[[4-[(4-phenoxyphenoxy)methyl]phenyl]methyl]piperidine Openeye Name: oxalic acid; 1-[[4-[(4-phenoxyphenoxy)methyl]phenyl]methyl]piperidine CAS Name: oxalic acid; 1-[[4-[(4-phenoxyphenoxy)methyl]phenyl]methyl]piperidine IUPAC Name: oxalic acid; 1-[[4-[(4-phenoxyphenoxy)methyl]phenyl]methyl]piperidine Traditional Name: oxalic acid; 1-[4-[(4-phenoxyphenoxy)methyl]benzyl]piperidine Formula: C27H29NO6 MolecularWeight: 463.52226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)COC3=CC=C(C=C3)OC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)COC3=CC=C(C=C3)OC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H27NO2.C2H2O4/c1-3-7-24(8-4-1)28-25-15-13-23(14-16-25)27-20-22-11-9-21(10-12-22)19-26-17-5-2-6-18-26;3-1(4)2(5)6/h1,3-4,7-16H,2,5-6,17-20H2;(H,3,4)(H,5,6)