5-bromanyl-6-methyl-3-nitro-pyridin-1-ium-2-amine

Systemtic Name: 5-bromanyl-6-methyl-3-nitro-pyridin-1-ium-2-amine Openeye Name: 5-bromo-6-methyl-3-nitro-pyridin-1-ium-2-amine CAS Name: 5-bromo-6-methyl-3-nitro-2-pyridin-1-iumamine IUPAC Name: 5-bromo-6-methyl-3-nitropyridin-1-ium-2-amine Traditional Name: (5-bromo-6-methyl-3-nitro-pyridin-1-ium-2-yl)amine Formula: C6H7BrN3O2+ MolecularWeight: 233.04268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=[NH+]1)N)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=C(C(=[NH+]1)N)[N+](=O)[O-])Br

InChI

InChI=1S/C6H6BrN3O2/c1-3-4(7)2-5(10(11)12)6(8)9-3/h2H,1H3,(H2,8,9)/p+1