1-(3-bromophenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine

Systemtic Name: 1-(3-bromophenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Openeye Name: 1-(3-bromophenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine CAS Name: 1-(3-bromophenyl)-N-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanimine IUPAC Name: 1-(3-bromophenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Traditional Name: (E)-(3-bromobenzylidene)-(4-pyridin-1-ium-2-ylpiperazino)amine Formula: C16H18BrN4+ MolecularWeight: 346.24492

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)N=CC3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)/N=C/C3=CC(=CC=C3)Br

InChI

InChI=1S/C16H17BrN4/c17-15-5-3-4-14(12-15)13-19-21-10-8-20(9-11-21)16-6-1-2-7-18-16/h1-7,12-13H,8-11H2/p+1/b19-13+