ethanedioic acid; 1-[(2-fluorophenyl)methyl]-4-(3-phenylpropyl)piperazine

Systemtic Name: ethanedioic acid; 1-[(2-fluorophenyl)methyl]-4-(3-phenylpropyl)piperazine Openeye Name: 1-[(2-fluorophenyl)methyl]-4-(3-phenylpropyl)piperazine; oxalic acid CAS Name: 1-[(2-fluorophenyl)methyl]-4-(3-phenylpropyl)piperazine; oxalic acid IUPAC Name: 1-[(2-fluorophenyl)methyl]-4-(3-phenylpropyl)piperazine; oxalic acid Traditional Name: 1-(2-fluorobenzyl)-4-(3-phenylpropyl)piperazine; oxalic acid Formula: C22H27FN2O4 MolecularWeight: 402.459183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=CC=C2)CC3=CC=CC=C3F.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CCCC2=CC=CC=C2)CC3=CC=CC=C3F.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H25FN2.C2H2O4/c21-20-11-5-4-10-19(20)17-23-15-13-22(14-16-23)12-6-9-18-7-2-1-3-8-18;3-1(4)2(5)6/h1-5,7-8,10-11H,6,9,12-17H2;(H,3,4)(H,5,6)