1-(4-chloranyl-3-nitro-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-(4-chloro-3-nitro-phenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-(4-chloro-3-nitrophenyl)-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-(4-chloro-3-nitrophenyl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(4-chloro-3-nitro-benzylidene)-(4-methylpiperazin-4-ium-1-yl)amine Formula: C12H16ClN4O2+ MolecularWeight: 283.73404

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)N=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)/N=C\C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H15ClN4O2/c1-15-4-6-16(7-5-15)14-9-10-2-3-11(13)12(8-10)17(18)19/h2-3,8-9H,4-7H2,1H3/p+1/b14-9-