[3,5-bis[(2-methylpropan-2-yl)oxy]phenyl]-diphenyl-sulfanium; 4-fluoranylbenzenesulfonate

Systemtic Name: [3,5-bis[(2-methylpropan-2-yl)oxy]phenyl]-diphenyl-sulfanium; 4-fluoranylbenzenesulfonate Openeye Name: (3,5-ditert-butoxyphenyl)-diphenyl-sulfonium; 4-fluorobenzenesulfonate CAS Name: [3,5-bis[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfonium; 4-fluorobenzenesulfonate IUPAC Name: [3,5-bis[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium; 4-fluorobenzenesulfonate Traditional Name: (3,5-ditert-butoxyphenyl)-diphenyl-sulfonium; 4-fluorobesylate Formula: C32H35FO5S2 MolecularWeight: 582.745703

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC1=CC(=CC(=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3)OC(C)(C)C.C1=CC(=CC=C1F)S(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)OC1=CC(=CC(=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3)OC(C)(C)C.C1=CC(=CC=C1F)S(=O)(=O)[O-]

InChI

InChI=1S/C26H31O2S.C6H5FO3S/c1-25(2,3)27-20-17-21(28-26(4,5)6)19-24(18-20)29(22-13-9-7-10-14-22)23-15-11-8-12-16-23;7-5-1-3-6(4-2-5)11(8,9)10/h7-19H,1-6H3;1-4H,(H,8,9,10)/q+1;/p-1