ethanedioic acid; 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-4-piperidin-1-yl-piperidine

Systemtic Name: ethanedioic acid; 1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]-4-piperidin-1-yl-piperidine Openeye Name: 1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-4-(1-piperidyl)piperidine; oxalic acid CAS Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-(1-piperidinyl)piperidine; oxalic acid IUPAC Name: 1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-piperidin-1-ylpiperidine; oxalic acid Traditional Name: 1-(4-benzoxy-3-methoxy-benzyl)-4-piperidino-piperidine; oxalic acid Formula: C27H36N2O6 MolecularWeight: 484.58454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCC(CC2)N3CCCCC3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCC(CC2)N3CCCCC3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H34N2O2.C2H2O4/c1-28-25-18-22(10-11-24(25)29-20-21-8-4-2-5-9-21)19-26-16-12-23(13-17-26)27-14-6-3-7-15-27;3-1(4)2(5)6/h2,4-5,8-11,18,23H,3,6-7,12-17,19-20H2,1H3;(H,3,4)(H,5,6)