[(E)-2-methylbut-1-enyl]-phenyl-iodanium; tris(fluoranyl)methanesulfonate

Systemtic Name: [(E)-2-methylbut-1-enyl]-phenyl-iodanium; tris(fluoranyl)methanesulfonate Openeye Name: [(E)-2-methylbut-1-enyl]-phenyl-iodonium; trifluoromethanesulfonate CAS Name: [(E)-2-methylbut-1-enyl]-phenyliodonium; trifluoromethanesulfonate IUPAC Name: [(E)-2-methylbut-1-enyl]-phenyliodanium; trifluoromethanesulfonate Traditional Name: [(E)-2-methylbut-1-enyl]-phenyl-iodonium triflate Formula: C12H14F3IO3S MolecularWeight: 422.20244

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14I.CHF3O3S/c1-3-10(2)9-12-11-7-5-4-6-8-11;2-1(3,4)8(5,6)7/h4-9H,3H2,1-2H3;(H,5,6,7)/q+1;/p-1/b10-9+;