6-nitro-7-(2-nitropropan-2-yl)-N-oxidanyl-7H-2,1,3-benzoxadiazol-4-imine oxide

Systemtic Name: 6-nitro-7-(2-nitropropan-2-yl)-N-oxidanyl-7H-2,1,3-benzoxadiazol-4-imine oxide Openeye Name: N-hydroxy-7-(1-methyl-1-nitro-ethyl)-6-nitro-7H-2,1,3-benzoxadiazol-4-imine oxide CAS Name: N-hydroxy-6-nitro-7-(2-nitropropan-2-yl)-7H-2,1,3-benzoxadiazol-4-imine oxide IUPAC Name: N-hydroxy-6-nitro-7-(2-nitropropan-2-yl)-7H-2,1,3-benzoxadiazol-4-imine oxide Traditional Name: N-hydroxy-7-(1-methyl-1-nitro-ethyl)-6-nitro-7H-benzofurazan-4-imine oxide Formula: C9H9N5O7 MolecularWeight: 299.19706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1C(=CC(=[N+](O)[O-])C2=NON=C12)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC(C)(C1C(=C/C(=[N+](\O)/[O-])/C2=NON=C12)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C9H9N5O7/c1-9(2,14(19)20)6-4(12(15)16)3-5(13(17)18)7-8(6)11-21-10-7/h3,6H,1-2H3,(H,17,18)