2-cyanoethynyl(phenyl)iodanium; tris(fluoranyl)methanesulfonate

Systemtic Name: 2-cyanoethynyl(phenyl)iodanium; tris(fluoranyl)methanesulfonate Openeye Name: 2-cyanoethynyl(phenyl)iodonium; trifluoromethanesulfonate CAS Name: 2-cyanoethynyl(phenyl)iodonium; trifluoromethanesulfonate IUPAC Name: 2-cyanoethynyl(phenyl)iodanium; trifluoromethanesulfonate Traditional Name: 2-cyanoethynyl(phenyl)iodonium triflate Formula: C10H5F3INO3S MolecularWeight: 403.11628

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)[I+]C#CC#N.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)[I+]C#CC#N.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C9H5IN.CHF3O3S/c11-8-4-7-10-9-5-2-1-3-6-9;2-1(3,4)8(5,6)7/h1-3,5-6H;(H,5,6,7)/q+1;/p-1