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

Systemtic Name: 1-cyclopentyl-4-[(4-methoxy-3-phenylmethoxy-phenyl)methyl]piperazine; ethanedioic acid Openeye Name: 1-[(3-benzyloxy-4-methoxy-phenyl)methyl]-4-cyclopentyl-piperazine; oxalic acid CAS Name: 1-cyclopentyl-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-cyclopentyl-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(3-benzoxy-4-methoxy-benzyl)-4-cyclopentyl-piperazine; oxalic acid Formula: C26H34N2O6 MolecularWeight: 470.55796

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)C3CCCC3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)C3CCCC3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H32N2O2.C2H2O4/c1-27-23-12-11-21(17-24(23)28-19-20-7-3-2-4-8-20)18-25-13-15-26(16-14-25)22-9-5-6-10-22;3-1(4)2(5)6/h2-4,7-8,11-12,17,22H,5-6,9-10,13-16,18-19H2,1H3;(H,3,4)(H,5,6)