5-nitro-6-oxidanylidene-2-(1,2,4-triazol-4-ylamino)-1H-pyrimidin-4-olate

Systemtic Name: 5-nitro-6-oxidanylidene-2-(1,2,4-triazol-4-ylamino)-1H-pyrimidin-4-olate Openeye Name: 5-nitro-6-oxo-2-(1,2,4-triazol-4-ylamino)-1H-pyrimidin-4-olate CAS Name: 5-nitro-6-oxo-2-(1,2,4-triazol-4-ylamino)-1H-pyrimidin-4-olate IUPAC Name: 5-nitro-6-oxo-2-(1,2,4-triazol-4-ylamino)-1H-pyrimidin-4-olate Traditional Name: 6-keto-5-nitro-2-(1,2,4-triazol-4-ylamino)-1H-pyrimidin-4-olate Formula: C6H4N7O4- MolecularWeight: 238.14046

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN=CN1NC2=NC(=C(C(=O)N2)[N+](=O)[O-])[O-]

Isomeric SMILES

C1=NN=CN1NC2=NC(=C(C(=O)N2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C6H5N7O4/c14-4-3(13(16)17)5(15)10-6(9-4)11-12-1-7-8-2-12/h1-2H,(H3,9,10,11,14,15)/p-1