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

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]piperazine; ethanedioic acid Openeye Name: 1-[(3-benzyloxy-4-methoxy-phenyl)methyl]-4-[(3,4-dimethoxyphenyl)methyl]piperazine; oxalic acid CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(3-benzoxy-4-methoxy-benzyl)-4-veratryl-piperazine; oxalic acid Formula: C30H36N2O8 MolecularWeight: 552.61544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)CC3=CC(=C(C=C3)OC)OCC4=CC=CC=C4)OC.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)CC3=CC(=C(C=C3)OC)OCC4=CC=CC=C4)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C28H34N2O4.C2H2O4/c1-31-25-11-9-23(17-27(25)33-3)19-29-13-15-30(16-14-29)20-24-10-12-26(32-2)28(18-24)34-21-22-7-5-4-6-8-22;3-1(4)2(5)6/h4-12,17-18H,13-16,19-21H2,1-3H3;(H,3,4)(H,5,6)