1-[(2,3-dimethoxyphenyl)methyl]-4-(4-phenylcyclohexyl)piperazine; ethanedioic acid

Systemtic Name: 1-[(2,3-dimethoxyphenyl)methyl]-4-(4-phenylcyclohexyl)piperazine; ethanedioic acid Openeye Name: 1-[(2,3-dimethoxyphenyl)methyl]-4-(4-phenylcyclohexyl)piperazine; oxalic acid CAS Name: 1-[(2,3-dimethoxyphenyl)methyl]-4-(4-phenylcyclohexyl)piperazine; oxalic acid IUPAC Name: 1-[(2,3-dimethoxyphenyl)methyl]-4-(4-phenylcyclohexyl)piperazine; oxalic acid Traditional Name: 1-o-veratryl-4-(4-phenylcyclohexyl)piperazine; oxalic acid Formula: C27H36N2O6 MolecularWeight: 484.58454

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN2CCN(CC2)C3CCC(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=CC=CC(=C1OC)CN2CCN(CC2)C3CCC(CC3)C4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H34N2O2.C2H2O4/c1-28-24-10-6-9-22(25(24)29-2)19-26-15-17-27(18-16-26)23-13-11-21(12-14-23)20-7-4-3-5-8-20;3-1(4)2(5)6/h3-10,21,23H,11-19H2,1-2H3;(H,3,4)(H,5,6)