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

Systemtic Name: 1-[(3-bromophenyl)methyl]-4-[(4-methylphenyl)methyl]piperazine; ethanedioic acid Openeye Name: 1-[(3-bromophenyl)methyl]-4-(p-tolylmethyl)piperazine; oxalic acid CAS Name: 1-[(3-bromophenyl)methyl]-4-[(4-methylphenyl)methyl]piperazine; oxalic acid IUPAC Name: 1-[(3-bromophenyl)methyl]-4-[(4-methylphenyl)methyl]piperazine; oxalic acid Traditional Name: 1-(3-bromobenzyl)-4-(4-methylbenzyl)piperazine; oxalic acid Formula: C21H25BrN2O4 MolecularWeight: 449.3382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)CC3=CC(=CC=C3)Br.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)CC3=CC(=CC=C3)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23BrN2.C2H2O4/c1-16-5-7-17(8-6-16)14-21-9-11-22(12-10-21)15-18-3-2-4-19(20)13-18;3-1(4)2(5)6/h2-8,13H,9-12,14-15H2,1H3;(H,3,4)(H,5,6)