(E)-2-diazonio-1-methoxy-2-[2-[2-oxidanylidene-2-(trifluoromethylsulfonylamino)ethyl]phenyl]ethenolate

Systemtic Name: (E)-2-diazonio-1-methoxy-2-[2-[2-oxidanylidene-2-(trifluoromethylsulfonylamino)ethyl]phenyl]ethenolate Openeye Name: (E)-2-diazonio-1-methoxy-2-[2-[2-oxo-2-(trifluoromethylsulfonylamino)ethyl]phenyl]ethenolate CAS Name: (E)-2-diazonio-1-methoxy-2-[2-[2-oxo-2-(trifluoromethylsulfonylamino)ethyl]phenyl]ethenolate IUPAC Name: (E)-2-diazonio-1-methoxy-2-[2-[2-oxo-2-(trifluoromethylsulfonylamino)ethyl]phenyl]ethenolate Traditional Name: (E)-2-diazonio-2-[2-[2-keto-2-(triflylamino)ethyl]phenyl]-1-methoxy-ethenolate Formula: C12H10F3N3O5S MolecularWeight: 365.28511

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C1=CC=CC=C1CC(=O)NS(=O)(=O)C(F)(F)F)[N+]#N)[O-]

Isomeric SMILES

CO/C(=C(\C1=CC=CC=C1CC(=O)NS(=O)(=O)C(F)(F)F)/[N+]#N)/[O-]

InChI

InChI=1S/C12H10F3N3O5S/c1-23-11(20)10(17-16)8-5-3-2-4-7(8)6-9(19)18-24(21,22)12(13,14)15/h2-5H,6H2,1H3,(H-,18,19,20)/b11-10+