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

Systemtic Name: [(E)-2-ethylhex-1-enyl]-phenyl-iodanium; tris(fluoranyl)methanesulfonate Openeye Name: [(E)-2-ethylhex-1-enyl]-phenyl-iodonium; trifluoromethanesulfonate CAS Name: [(E)-2-ethylhex-1-enyl]-phenyliodonium; trifluoromethanesulfonate IUPAC Name: [(E)-2-ethylhex-1-enyl]-phenyliodanium; trifluoromethanesulfonate Traditional Name: [(E)-2-ethylhex-1-enyl]-phenyl-iodonium triflate Formula: C15H20F3IO3S MolecularWeight: 464.28218

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20I.CHF3O3S/c1-3-5-9-13(4-2)12-15-14-10-7-6-8-11-14;2-1(3,4)8(5,6)7/h6-8,10-12H,3-5,9H2,1-2H3;(H,5,6,7)/q+1;/p-1/b13-12+;