(5-bromanyl-4,6,7-trimethyl-1-benzofuran-3-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (5-bromanyl-4,6,7-trimethyl-1-benzofuran-3-yl) tris(fluoranyl)methanesulfonate Openeye Name: (5-bromo-4,6,7-trimethyl-benzofuran-3-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (5-bromo-4,6,7-trimethyl-3-benzofuranyl) ester IUPAC Name: (5-bromo-4,6,7-trimethyl-1-benzofuran-3-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (5-bromo-4,6,7-trimethyl-benzofuran-3-yl) ester Formula: C12H10BrF3O4S MolecularWeight: 387.16961

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1C)Br)C)C(=CO2)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=C2C(=C(C(=C1C)Br)C)C(=CO2)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C12H10BrF3O4S/c1-5-6(2)11-9(7(3)10(5)13)8(4-19-11)20-21(17,18)12(14,15)16/h4H,1-3H3