(3,3-dimethyl-4-oxidanylidene-2H-chromen-7-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (3,3-dimethyl-4-oxidanylidene-2H-chromen-7-yl) tris(fluoranyl)methanesulfonate Openeye Name: (3,3-dimethyl-4-oxo-chroman-7-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (3,3-dimethyl-4-oxo-3,4-dihydro-2H-1-benzopyran-7-yl) ester IUPAC Name: (3,3-dimethyl-4-oxo-2H-chromen-7-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (4-keto-3,3-dimethyl-chroman-7-yl) ester Formula: C12H11F3O5S MolecularWeight: 324.27295

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C(C1=O)C=CC(=C2)OS(=O)(=O)C(F)(F)F)C

Isomeric SMILES

CC1(COC2=C(C1=O)C=CC(=C2)OS(=O)(=O)C(F)(F)F)C

InChI

InChI=1S/C12H11F3O5S/c1-11(2)6-19-9-5-7(3-4-8(9)10(11)16)20-21(17,18)12(13,14)15/h3-5H,6H2,1-2H3