[5-(2-nitropropan-2-yl)-1-oxidanylidene-3,5-dihydro-2,1,3-benzoxadiazol-1-ium-4-ylidene]-bis(oxidanidyl)azanium

Systemtic Name: [5-(2-nitropropan-2-yl)-1-oxidanylidene-3,5-dihydro-2,1,3-benzoxadiazol-1-ium-4-ylidene]-bis(oxidanidyl)azanium Openeye Name: [5-(1-methyl-1-nitro-ethyl)-1-oxo-3,5-dihydro-2,1,3-benzoxadiazol-1-ium-4-ylidene]-dioxido-ammonium CAS Name: [5-(2-nitropropan-2-yl)-1-oxo-3,5-dihydro-2,1,3-benzoxadiazol-1-ium-4-ylidene]-dioxidoammonium IUPAC Name: [5-(2-nitropropan-2-yl)-1-oxo-3,5-dihydro-2,1,3-benzoxadiazol-1-ium-4-ylidene]-dioxidoazanium Traditional Name: [1-keto-5-(1-methyl-1-nitro-ethyl)-3,5-dihydrobenzofurazan-1-ium-4-ylidene]-dioxido-ammonium Formula: C9H10N4O6 MolecularWeight: 270.1989

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C=CC2=C(C1=[N+]([O-])[O-])NO[N+]2=O)[N+](=O)[O-]

Isomeric SMILES

CC([N+](=O)[O-])(C1/C(=[N+](\[O-])/[O-])/C2=C([N+](=O)ON2)C=C1)C

InChI

InChI=1S/C9H10N4O6/c1-9(2,13(17)18)5-3-4-6-7(8(5)11(14)15)10-19-12(6)16/h3-5,10H,1-2H3