(4-butylsulfanylphenyl) tris(fluoranyl)methanesulfonate

Systemtic Name: (4-butylsulfanylphenyl) tris(fluoranyl)methanesulfonate Openeye Name: (4-butylsulfanylphenyl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [4-(butylthio)phenyl] ester IUPAC Name: (4-butylsulfanylphenyl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [4-(butylthio)phenyl] ester Formula: C11H13F3O3S2 MolecularWeight: 314.34433

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CCCCSC1=CC=C(C=C1)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C11H13F3O3S2/c1-2-3-8-18-10-6-4-9(5-7-10)17-19(15,16)11(12,13)14/h4-7H,2-3,8H2,1H3