(4-butoxyphenyl)-diethyl-sulfanium; tris(fluoranyl)methanesulfonate

Systemtic Name: (4-butoxyphenyl)-diethyl-sulfanium; tris(fluoranyl)methanesulfonate Openeye Name: (4-butoxyphenyl)-diethyl-sulfonium; trifluoromethanesulfonate CAS Name: (4-butoxyphenyl)-diethylsulfonium; trifluoromethanesulfonate IUPAC Name: (4-butoxyphenyl)-diethylsulfanium; trifluoromethanesulfonate Traditional Name: (4-butoxyphenyl)-diethyl-sulfonium triflate Formula: C15H23F3O4S2 MolecularWeight: 388.46593

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H23OS.CHF3O3S/c1-4-7-12-15-13-8-10-14(11-9-13)16(5-2)6-3;2-1(3,4)8(5,6)7/h8-11H,4-7,12H2,1-3H3;(H,5,6,7)/q+1;/p-1