azanium 2-[6-imidazol-1-yl-7-nitro-2,3-bis(oxidanylidene)-1H-pyrido[2,3-b]pyrazin-4-yl]ethanoate

Systemtic Name: azanium 2-[6-imidazol-1-yl-7-nitro-2,3-bis(oxidanylidene)-1H-pyrido[2,3-b]pyrazin-4-yl]ethanoate Openeye Name: ammonium 2-(6-imidazol-1-yl-7-nitro-2,3-dioxo-1H-pyrido[2,3-b]pyrazin-4-yl)acetate CAS Name: ammonium 2-[6-(1-imidazolyl)-7-nitro-2,3-dioxo-1H-pyrido[2,3-b]pyrazin-4-yl]acetate IUPAC Name: azanium 2-(6-imidazol-1-yl-7-nitro-2,3-dioxo-1H-pyrido[2,3-b]pyrazin-4-yl)acetate Traditional Name: ammonium 2-(6-imidazol-1-yl-2,3-diketo-7-nitro-1H-pyrido[2,3-b]pyrazin-4-yl)acetate Formula: C12H11N7O6 MolecularWeight: 349.25904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=N1)C2=C(C=C3C(=N2)N(C(=O)C(=O)N3)CC(=O)[O-])[N+](=O)[O-].[NH4+]

Isomeric SMILES

C1=CN(C=N1)C2=C(C=C3C(=N2)N(C(=O)C(=O)N3)CC(=O)[O-])[N+](=O)[O-].[NH4+]

InChI

InChI=1S/C12H8N6O6.H3N/c19-8(20)4-17-9-6(14-11(21)12(17)22)3-7(18(23)24)10(15-9)16-2-1-13-5-16;/h1-3,5H,4H2,(H,14,21)(H,19,20);1H3