[2-(2-cyclohexylphenyl)phenyl]iodanium; tris(fluoranyl)methanesulfonate

Systemtic Name: [2-(2-cyclohexylphenyl)phenyl]iodanium; tris(fluoranyl)methanesulfonate Openeye Name: [2-(2-cyclohexylphenyl)phenyl]iodonium; trifluoromethanesulfonate CAS Name: [2-(2-cyclohexylphenyl)phenyl]iodonium; trifluoromethanesulfonate IUPAC Name: [2-(2-cyclohexylphenyl)phenyl]iodanium; trifluoromethanesulfonate Traditional Name: [2-(2-cyclohexylphenyl)phenyl]iodonium triflate Formula: C19H20F3IO3S MolecularWeight: 512.32498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=CC=C2C3=CC=CC=C3[IH+].C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

C1CCC(CC1)C2=CC=CC=C2C3=CC=CC=C3[IH+].C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C18H20I.CHF3O3S/c19-18-13-7-6-12-17(18)16-11-5-4-10-15(16)14-8-2-1-3-9-14;2-1(3,4)8(5,6)7/h4-7,10-14,19H,1-3,8-9H2;(H,5,6,7)/q+1;/p-1