(2-fluoranyl-4-pentyl-phenyl) tris(fluoranyl)methanesulfonate

Systemtic Name: (2-fluoranyl-4-pentyl-phenyl) tris(fluoranyl)methanesulfonate Openeye Name: (2-fluoro-4-pentyl-phenyl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (2-fluoro-4-pentylphenyl) ester IUPAC Name: (2-fluoro-4-pentylphenyl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (4-amyl-2-fluoro-phenyl) ester Formula: C12H14F4O3S MolecularWeight: 314.296373

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)F

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OS(=O)(=O)C(F)(F)F)F

InChI

InChI=1S/C12H14F4O3S/c1-2-3-4-5-9-6-7-11(10(13)8-9)19-20(17,18)12(14,15)16/h6-8H,2-5H2,1H3