5,7-dinitro-3-oxidanidyl-1H-2,1,3-benzoxadiazol-3-ium-4-one

Systemtic Name: 5,7-dinitro-3-oxidanidyl-1H-2,1,3-benzoxadiazol-3-ium-4-one Openeye Name: 5,7-dinitro-3-oxido-1H-2,1,3-benzoxadiazol-3-ium-4-one CAS Name: 5,7-dinitro-3-oxido-1H-2,1,3-benzoxadiazol-3-ium-4-one IUPAC Name: 5,7-dinitro-3-oxido-1H-2,1,3-benzoxadiazol-3-ium-4-one Traditional Name: 5,7-dinitro-3-oxido-1H-benzofurazan-3-ium-4-one Formula: C6H2N4O7 MolecularWeight: 242.10268

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)C2=[N+](ONC2=C1[N+](=O)[O-])[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=O)C2=[N+](ONC2=C1[N+](=O)[O-])[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H2N4O7/c11-6-3(9(14)15)1-2(8(12)13)4-5(6)10(16)17-7-4/h1,7H