1-(2-chloranyl-6-fluoranyl-phenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine

Systemtic Name: 1-(2-chloranyl-6-fluoranyl-phenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Openeye Name: 1-(2-chloro-6-fluoro-phenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine CAS Name: 1-(2-chloro-6-fluorophenyl)-N-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methanimine IUPAC Name: 1-(2-chloro-6-fluorophenyl)-N-(4-pyridin-1-ium-2-ylpiperazin-1-yl)methanimine Traditional Name: (E)-(2-chloro-6-fluoro-benzylidene)-(4-pyridin-1-ium-2-ylpiperazino)amine Formula: C16H17ClFN4+ MolecularWeight: 319.784383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)N=CC3=C(C=CC=C3Cl)F

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)/N=C/C3=C(C=CC=C3Cl)F

InChI

InChI=1S/C16H16ClFN4/c17-14-4-3-5-15(18)13(14)12-20-22-10-8-21(9-11-22)16-6-1-2-7-19-16/h1-7,12H,8-11H2/p+1/b20-12+