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

Systemtic Name: 1-(4-bromophenyl)-N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine Openeye Name: 1-(4-bromophenyl)-N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine CAS Name: 1-(4-bromophenyl)-N-[4-[(2-chlorophenyl)methyl]-1-piperazin-4-iumyl]methanimine IUPAC Name: 1-(4-bromophenyl)-N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine Traditional Name: (E)-(4-bromobenzylidene)-[4-(2-chlorobenzyl)piperazin-4-ium-1-yl]amine Formula: C18H20BrClN3+ MolecularWeight: 393.7285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2Cl)N=CC3=CC=C(C=C3)Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2Cl)/N=C/C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrClN3/c19-17-7-5-15(6-8-17)13-21-23-11-9-22(10-12-23)14-16-3-1-2-4-18(16)20/h1-8,13H,9-12,14H2/p+1/b21-13+