(2-butoxyphenyl)-diphenyl-sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (2-butoxyphenyl)-diphenyl-sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: (2-butoxyphenyl)-diphenyl-sulfonium; trifluoromethanesulfonate CAS Name: (2-butoxyphenyl)-diphenylsulfonium; trifluoromethanesulfonate IUPAC Name: (2-butoxyphenyl)-diphenylsulfanium; trifluoromethanesulfonate Traditional Name: (2-butoxyphenyl)-diphenyl-sulfonium triflate Formula: C23H23F3O4S2 MolecularWeight: 484.55153

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1[S+](C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

Isomeric SMILES

CCCCOC1=CC=CC=C1[S+](C2=CC=CC=C2)C3=CC=CC=C3.C(F)(F)(F)S(=O)(=O)[O-]

InChI

InChI=1S/C22H23OS.CHF3O3S/c1-2-3-18-23-21-16-10-11-17-22(21)24(19-12-6-4-7-13-19)20-14-8-5-9-15-20;2-1(3,4)8(5,6)7/h4-17H,2-3,18H2,1H3;(H,5,6,7)/q+1;/p-1