7-nitro-4-(2-nitropropan-2-yl)-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium

Systemtic Name: 7-nitro-4-(2-nitropropan-2-yl)-3-oxidanidyl-2,1,3-benzoxadiazol-3-ium Openeye Name: 4-(1-methyl-1-nitro-ethyl)-7-nitro-3-oxido-2,1,3-benzoxadiazol-3-ium CAS Name: 7-nitro-4-(2-nitropropan-2-yl)-3-oxido-2,1,3-benzoxadiazol-3-ium IUPAC Name: 7-nitro-4-(2-nitropropan-2-yl)-3-oxido-2,1,3-benzoxadiazol-3-ium Traditional Name: 7-(1-methyl-1-nitro-ethyl)-4-nitro-1-oxido-benzofurazan-1-ium Formula: C9H8N4O6 MolecularWeight: 268.18302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=C(C2=NO[N+](=C12)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1=CC=C(C2=NO[N+](=C12)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H8N4O6/c1-9(2,13(17)18)5-3-4-6(11(14)15)7-8(5)12(16)19-10-7/h3-4H,1-2H3