4-[3,5-bis(trifluoromethyl)phenyl]-2-oxidanidyl-1,2,5-oxadiazol-2-ium-3-carbonitrile

Systemtic Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-oxidanidyl-1,2,5-oxadiazol-2-ium-3-carbonitrile Openeye Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-oxido-1,2,5-oxadiazol-2-ium-3-carbonitrile CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-oxido-1,2,5-oxadiazol-2-ium-3-carbonitrile IUPAC Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-oxido-1,2,5-oxadiazol-2-ium-3-carbonitrile Traditional Name: 4-[3,5-bis(trifluoromethyl)phenyl]-2-oxido-furazan-2-ium-3-carbonitrile Formula: C11H3F6N3O2 MolecularWeight: 323.150839

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=NO[N+](=C2C#N)[O-]

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C2=NO[N+](=C2C#N)[O-]

InChI

InChI=1S/C11H3F6N3O2/c12-10(13,14)6-1-5(2-7(3-6)11(15,16)17)9-8(4-18)20(21)22-19-9/h1-3H