(4,4-dimethyl-2,3-dihydrothiochromen-5-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (4,4-dimethyl-2,3-dihydrothiochromen-5-yl) tris(fluoranyl)methanesulfonate Openeye Name: (4,4-dimethylthiochroman-5-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (4,4-dimethyl-2,3-dihydro-1-benzothiopyran-5-yl) ester IUPAC Name: (4,4-dimethyl-2,3-dihydrothiochromen-5-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (4,4-dimethylthiochroman-5-yl) ester Formula: C12H13F3O3S2 MolecularWeight: 326.35503

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCSC2=CC=CC(=C21)OS(=O)(=O)C(F)(F)F)C

Isomeric SMILES

CC1(CCSC2=CC=CC(=C21)OS(=O)(=O)C(F)(F)F)C

InChI

InChI=1S/C12H13F3O3S2/c1-11(2)6-7-19-9-5-3-4-8(10(9)11)18-20(16,17)12(13,14)15/h3-5H,6-7H2,1-2H3