1-(3-bromanyl-4-methoxy-phenyl)-N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine

Systemtic Name: 1-(3-bromanyl-4-methoxy-phenyl)-N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine Openeye Name: 1-(3-bromo-4-methoxy-phenyl)-N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine CAS Name: 1-(3-bromo-4-methoxyphenyl)-N-[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]methanimine IUPAC Name: 1-(3-bromo-4-methoxyphenyl)-N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine Traditional Name: (Z)-(3-bromo-4-methoxy-benzylidene)-[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]amine Formula: C19H22BrClN3O+ MolecularWeight: 423.75448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NN2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N\N2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)Br

InChI

InChI=1S/C19H21BrClN3O/c1-25-19-7-4-16(12-18(19)20)13-22-24-10-8-23(9-11-24)14-15-2-5-17(21)6-3-15/h2-7,12-13H,8-11,14H2,1H3/p+1/b22-13-