4-nitro-1-oxidanidyl-6-(trifluoromethylsulfonyl)-2,1,3-benzoxadiazol-1-ium

Systemtic Name: 4-nitro-1-oxidanidyl-6-(trifluoromethylsulfonyl)-2,1,3-benzoxadiazol-1-ium Openeye Name: 4-nitro-1-oxido-6-(trifluoromethylsulfonyl)-2,1,3-benzoxadiazol-1-ium CAS Name: 4-nitro-1-oxido-6-(trifluoromethylsulfonyl)-2,1,3-benzoxadiazol-1-ium IUPAC Name: 4-nitro-1-oxido-6-(trifluoromethylsulfonyl)-2,1,3-benzoxadiazol-1-ium Traditional Name: 4-nitro-1-oxido-6-triflyl-benzofurazan-1-ium Formula: C7H2F3N3O6S MolecularWeight: 313.16749

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H2F3N3O6S/c8-7(9,10)20(17,18)3-1-4(12(14)15)6-5(2-3)13(16)19-11-6/h1-2H