1-(5-bromanyl-2-fluoranyl-phenyl)-N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine

Systemtic Name: 1-(5-bromanyl-2-fluoranyl-phenyl)-N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine Openeye Name: 1-(5-bromo-2-fluoro-phenyl)-N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine CAS Name: 1-(5-bromo-2-fluorophenyl)-N-[4-[(4-chlorophenyl)methyl]-1-piperazin-4-iumyl]methanimine IUPAC Name: 1-(5-bromo-2-fluorophenyl)-N-[4-[(4-chlorophenyl)methyl]piperazin-4-ium-1-yl]methanimine Traditional Name: (Z)-(5-bromo-2-fluoro-benzylidene)-[4-(4-chlorobenzyl)piperazin-4-ium-1-yl]amine Formula: C18H19BrClFN3+ MolecularWeight: 411.718963

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=C(C=C2)Cl)N=CC3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=C(C=C2)Cl)/N=C\C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C18H18BrClFN3/c19-16-3-6-18(21)15(11-16)12-22-24-9-7-23(8-10-24)13-14-1-4-17(20)5-2-14/h1-6,11-12H,7-10,13H2/p+1/b22-12-