4,6-dinitro-1-oxidanidyl-2,1,3-benzoxadiazol-1-ium

Systemtic Name: 4,6-dinitro-1-oxidanidyl-2,1,3-benzoxadiazol-1-ium Openeye Name: 4,6-dinitro-1-oxido-2,1,3-benzoxadiazol-1-ium CAS Name: 4,6-dinitro-1-oxido-2,1,3-benzoxadiazol-1-ium IUPAC Name: 4,6-dinitro-1-oxido-2,1,3-benzoxadiazol-1-ium Traditional Name: 4,6-dinitro-1-oxido-benzofurazan-1-ium Formula: C6H2N4O6 MolecularWeight: 226.10328

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C2=NO[N+](=C21)[O-])[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C2=NO[N+](=C21)[O-])[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C6H2N4O6/c11-8(12)3-1-4(9(13)14)6-5(2-3)10(15)16-7-6/h1-2H