diphenylsulfanium; [4-[(2-methylpropan-2-yl)oxy]phenyl] 2-(trifluoromethyl)benzenesulfonate

Systemtic Name: diphenylsulfanium; [4-[(2-methylpropan-2-yl)oxy]phenyl] 2-(trifluoromethyl)benzenesulfonate Openeye Name: (4-tert-butoxyphenyl) 2-(trifluoromethyl)benzenesulfonate; diphenylsulfonium CAS Name: diphenylsulfonium; 2-(trifluoromethyl)benzenesulfonic acid [4-[(2-methylpropan-2-yl)oxy]phenyl] ester IUPAC Name: diphenylsulfanium; [4-[(2-methylpropan-2-yl)oxy]phenyl] 2-(trifluoromethyl)benzenesulfonate Traditional Name: diphenylsulfonium; 2-(trifluoromethyl)benzenesulfonic acid (4-tert-butoxyphenyl) ester Formula: C29H28F3O4S2+ MolecularWeight: 561.65543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2C(F)(F)F.C1=CC=C(C=C1)[SH+]C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC1=CC=C(C=C1)OS(=O)(=O)C2=CC=CC=C2C(F)(F)F.C1=CC=C(C=C1)[SH+]C2=CC=CC=C2

InChI

InChI=1S/C17H17F3O4S.C12H10S/c1-16(2,3)23-12-8-10-13(11-9-12)24-25(21,22)15-7-5-4-6-14(15)17(18,19)20;1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h4-11H,1-3H3;1-10H/p+1