[6-(2-nitropropan-2-yl)-3-oxidanidyl-1,6-dihydro-2,1,3-benzoxadiazol-3-ium-7-yl]-oxidanyl-oxidanylidene-azanium

Systemtic Name: [6-(2-nitropropan-2-yl)-3-oxidanidyl-1,6-dihydro-2,1,3-benzoxadiazol-3-ium-7-yl]-oxidanyl-oxidanylidene-azanium Openeye Name: hydroxy-[6-(1-methyl-1-nitro-ethyl)-3-oxido-1,6-dihydro-2,1,3-benzoxadiazol-3-ium-7-yl]-oxo-ammonium CAS Name: hydroxy-[6-(2-nitropropan-2-yl)-3-oxido-1,6-dihydro-2,1,3-benzoxadiazol-3-ium-7-yl]-oxoammonium IUPAC Name: hydroxy-[6-(2-nitropropan-2-yl)-3-oxido-1,6-dihydro-2,1,3-benzoxadiazol-3-ium-7-yl]-oxoazanium Traditional Name: hydroxy-keto-[5-(1-methyl-1-nitro-ethyl)-1-oxido-3,5-dihydrobenzofurazan-1-ium-4-yl]ammonium Formula: C9H11N4O6+ MolecularWeight: 271.20684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C=CC2=[N+](ONC2=C1[N+](=O)O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1C=CC2=[N+](ONC2=C1[N+](=O)O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H11N4O6/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,(H,14,15)/q+1