[1-[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]-1,2,4-triazol-4-ium-4-yl]-nitro-azanide

Systemtic Name: [1-[2-[(5-bromanylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]-1,2,4-triazol-4-ium-4-yl]-nitro-azanide Openeye Name: [1-[2-[(5-bromo-2-pyridyl)amino]-2-oxo-ethyl]-1,2,4-triazol-4-ium-4-yl]-nitro-azanide CAS Name: [1-[2-[(5-bromo-2-pyridinyl)amino]-2-oxoethyl]-1,2,4-triazol-4-ium-4-yl]-nitroazanide IUPAC Name: [1-[2-[(5-bromopyridin-2-yl)amino]-2-oxoethyl]-1,2,4-triazol-4-ium-4-yl]-nitroazanide Traditional Name: [1-[2-[(5-bromo-2-pyridyl)amino]-2-keto-ethyl]-1,2,4-triazol-4-ium-4-yl]-nitro-azanide Formula: C9H8BrN7O3 MolecularWeight: 342.10892

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1Br)NC(=O)CN2C=[N+](C=N2)[N-][N+](=O)[O-]

Isomeric SMILES

C1=CC(=NC=C1Br)NC(=O)CN2C=[N+](C=N2)[N-][N+](=O)[O-]

InChI

InChI=1S/C9H8BrN7O3/c10-7-1-2-8(11-3-7)13-9(18)4-15-6-16(5-12-15)14-17(19)20/h1-3,5-6H,4H2,(H,11,13,18)