iodanium [2-(2-butan-2-ylphenyl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: iodanium [2-(2-butan-2-ylphenyl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: iodonium [2-(2-sec-butylphenyl)phenyl] trifluoromethanesulfonate CAS Name: iodonium trifluoromethanesulfonic acid [2-(2-butan-2-ylphenyl)phenyl] ester IUPAC Name: iodanium [2-(2-butan-2-ylphenyl)phenyl] trifluoromethanesulfonate Traditional Name: iodonium trifluoromethanesulfonic acid [2-(2-sec-butylphenyl)phenyl] ester Formula: C17H19F3IO3S+ MolecularWeight: 487.29564

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1C2=CC=CC=C2OS(=O)(=O)C(F)(F)F.[IH2+]

Isomeric SMILES

CCC(C)C1=CC=CC=C1C2=CC=CC=C2OS(=O)(=O)C(F)(F)F.[IH2+]

InChI

InChI=1S/C17H17F3O3S.H2I/c1-3-12(2)13-8-4-5-9-14(13)15-10-6-7-11-16(15)23-24(21,22)17(18,19)20;/h4-12H,3H2,1-2H3;1H2/q;+1