3-bromanyl-4-methyl-5-nitro-pyridin-1-ium-2-amine

Systemtic Name: 3-bromanyl-4-methyl-5-nitro-pyridin-1-ium-2-amine Openeye Name: 3-bromo-4-methyl-5-nitro-pyridin-1-ium-2-amine CAS Name: 3-bromo-4-methyl-5-nitro-2-pyridin-1-iumamine IUPAC Name: 3-bromo-4-methyl-5-nitropyridin-1-ium-2-amine Traditional Name: (3-bromo-4-methyl-5-nitro-pyridin-1-ium-2-yl)amine Formula: C6H7BrN3O2+ MolecularWeight: 233.04268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[NH+]C=C1[N+](=O)[O-])N)Br

Isomeric SMILES

CC1=C(C(=[NH+]C=C1[N+](=O)[O-])N)Br

InChI

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