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

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazine; ethanedioic acid Openeye Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazine; oxalic acid CAS Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-[(3-bromophenyl)methyl]-4-[(2-fluorophenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(3-bromobenzyl)-4-(2-fluorobenzyl)piperazine; oxalic acid Formula: C20H22BrFN2O4 MolecularWeight: 453.302083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Br)CC3=CC=CC=C3F.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Br)CC3=CC=CC=C3F.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H20BrFN2.C2H2O4/c19-17-6-3-4-15(12-17)13-21-8-10-22(11-9-21)14-16-5-1-2-7-18(16)20;3-1(4)2(5)6/h1-7,12H,8-11,13-14H2;(H,3,4)(H,5,6)