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

Systemtic Name: ethanedioic acid; 1-[1-[(3-methoxy-4-phenylmethoxy-phenyl)methyl]piperidin-4-yl]-4-phenyl-piperazine Openeye Name: 1-[1-[(4-benzyloxy-3-methoxy-phenyl)methyl]-4-piperidyl]-4-phenyl-piperazine; oxalic acid CAS Name: 1-[1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]-4-piperidinyl]-4-phenylpiperazine; oxalic acid IUPAC Name: 1-[1-[(3-methoxy-4-phenylmethoxyphenyl)methyl]piperidin-4-yl]-4-phenylpiperazine; oxalic acid Traditional Name: 1-[1-(4-benzoxy-3-methoxy-benzyl)-4-piperidyl]-4-phenyl-piperazine; oxalic acid Formula: C32H39N3O6 MolecularWeight: 561.66856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4)OCC5=CC=CC=C5.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN2CCC(CC2)N3CCN(CC3)C4=CC=CC=C4)OCC5=CC=CC=C5.C(=O)(C(=O)O)O

InChI

InChI=1S/C30H37N3O2.C2H2O4/c1-34-30-22-26(12-13-29(30)35-24-25-8-4-2-5-9-25)23-31-16-14-28(15-17-31)33-20-18-32(19-21-33)27-10-6-3-7-11-27;3-1(4)2(5)6/h2-13,22,28H,14-21,23-24H2,1H3;(H,3,4)(H,5,6)