6-chloranyl-N2-(4-methylphenyl)-3-nitro-pyridin-1-ium-2,4-diamine

Systemtic Name: 6-chloranyl-N2-(4-methylphenyl)-3-nitro-pyridin-1-ium-2,4-diamine Openeye Name: 6-chloro-3-nitro-N2-(p-tolyl)pyridin-1-ium-2,4-diamine CAS Name: 6-chloro-N2-(4-methylphenyl)-3-nitropyridin-1-ium-2,4-diamine IUPAC Name: 6-chloro-2-N-(4-methylphenyl)-3-nitropyridin-1-ium-2,4-diamine Traditional Name: (4-amino-6-chloro-3-nitro-pyridin-1-ium-2-yl)-(p-tolyl)amine Formula: C12H12ClN4O2+ MolecularWeight: 279.70228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C(=CC(=[NH+]2)Cl)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C(=CC(=[NH+]2)Cl)N)[N+](=O)[O-]

InChI

InChI=1S/C12H11ClN4O2/c1-7-2-4-8(5-3-7)15-12-11(17(18)19)9(14)6-10(13)16-12/h2-6H,1H3,(H3,14,15,16)/p+1