(4-methylphenyl)-phenyl-iodanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (4-methylphenyl)-phenyl-iodanium; tris(fluoranyl)methanesulfonate Openeye Name: phenyl(p-tolyl)iodonium; trifluoromethanesulfonate CAS Name: (4-methylphenyl)-phenyliodonium; trifluoromethanesulfonate IUPAC Name: (4-methylphenyl)-phenyliodanium; trifluoromethanesulfonate Traditional Name: phenyl(p-tolyl)iodonium triflate Formula: C14H12F3IO3S MolecularWeight: 444.20796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)[I+]C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)[I+]C2=CC=CC=C2.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C13H12I.CHF3O3S/c1-11-7-9-13(10-8-11)14-12-5-3-2-4-6-12;2-1(3,4)8(5,6)7/h2-10H,1H3;(H,5,6,7)/q+1;/p-1