sulfanium [2-(2,3-dibutylphenyl)-2-oxidanylidene-ethyl] tris(fluoranyl)methanesulfonate

Systemtic Name: sulfanium [2-(2,3-dibutylphenyl)-2-oxidanylidene-ethyl] tris(fluoranyl)methanesulfonate Openeye Name: sulfonium [2-(2,3-dibutylphenyl)-2-oxo-ethyl] trifluoromethanesulfonate CAS Name: sulfonium trifluoromethanesulfonic acid [2-(2,3-dibutylphenyl)-2-oxoethyl] ester IUPAC Name: sulfanium [2-(2,3-dibutylphenyl)-2-oxoethyl] trifluoromethanesulfonate Traditional Name: sulfonium trifluoromethanesulfonic acid [2-(2,3-dibutylphenyl)-2-keto-ethyl] ester Formula: C17H26F3O4S2+ MolecularWeight: 415.51115

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC(=C1CCCC)C(=O)COS(=O)(=O)C(F)(F)F.[SH3+]

Isomeric SMILES

CCCCC1=CC=CC(=C1CCCC)C(=O)COS(=O)(=O)C(F)(F)F.[SH3+]

InChI

InChI=1S/C17H23F3O4S.H2S/c1-3-5-8-13-9-7-11-15(14(13)10-6-4-2)16(21)12-24-25(22,23)17(18,19)20;/h7,9,11H,3-6,8,10,12H2,1-2H3;1H2/p+1