(4-butylsulfanylphenyl) tris(fluoranyl)methanesulfonate; diphenylsulfanium

Systemtic Name: (4-butylsulfanylphenyl) tris(fluoranyl)methanesulfonate; diphenylsulfanium Openeye Name: (4-butylsulfanylphenyl) trifluoromethanesulfonate; diphenylsulfonium CAS Name: diphenylsulfonium; trifluoromethanesulfonic acid [4-(butylthio)phenyl] ester IUPAC Name: (4-butylsulfanylphenyl) trifluoromethanesulfonate; diphenylsulfanium Traditional Name: diphenylsulfonium; trifluoromethanesulfonic acid [4-(butylthio)phenyl] ester Formula: C23H24F3O3S3+ MolecularWeight: 501.62507

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F.C1=CC=C(C=C1)[SH+]C2=CC=CC=C2

Isomeric SMILES

CCCCSC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F.C1=CC=C(C=C1)[SH+]C2=CC=CC=C2

InChI

InChI=1S/C12H10S.C11H13F3O3S2/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;1-2-3-8-18-10-6-4-9(5-7-10)17-19(15,16)11(12,13)14/h1-10H;4-7H,2-3,8H2,1H3/p+1