(7-cyano-2,2-dimethyl-3H-1-benzofuran-4-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (7-cyano-2,2-dimethyl-3H-1-benzofuran-4-yl) tris(fluoranyl)methanesulfonate Openeye Name: (7-cyano-2,2-dimethyl-3H-benzofuran-4-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (7-cyano-2,2-dimethyl-3H-benzofuran-4-yl) ester IUPAC Name: (7-cyano-2,2-dimethyl-3H-1-benzofuran-4-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (7-cyano-2,2-dimethyl-coumaran-4-yl) ester Formula: C12H10F3NO4S MolecularWeight: 321.27231

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C=CC(=C2O1)C#N)OS(=O)(=O)C(F)(F)F)C

Isomeric SMILES

CC1(CC2=C(C=CC(=C2O1)C#N)OS(=O)(=O)C(F)(F)F)C

InChI

InChI=1S/C12H10F3NO4S/c1-11(2)5-8-9(20-21(17,18)12(13,14)15)4-3-7(6-16)10(8)19-11/h3-4H,5H2,1-2H3