1-[(2-bromophenyl)methyl]-4-[(4-chlorophenyl)methyl]piperazin-1-ium

Systemtic Name: 1-[(2-bromophenyl)methyl]-4-[(4-chlorophenyl)methyl]piperazin-1-ium Openeye Name: 1-[(2-bromophenyl)methyl]-4-[(4-chlorophenyl)methyl]piperazin-1-ium CAS Name: 1-[(2-bromophenyl)methyl]-4-[(4-chlorophenyl)methyl]piperazin-1-ium IUPAC Name: 1-[(2-bromophenyl)methyl]-4-[(4-chlorophenyl)methyl]piperazin-1-ium Traditional Name: 1-(2-bromobenzyl)-4-(4-chlorobenzyl)piperazin-1-ium Formula: C18H21BrClN2+ MolecularWeight: 380.72974

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2Br)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2Br)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H20BrClN2/c19-18-4-2-1-3-16(18)14-22-11-9-21(10-12-22)13-15-5-7-17(20)8-6-15/h1-8H,9-14H2/p+1