(4-pentylphenyl) tris(fluoranyl)methanesulfonate

Systemtic Name: (4-pentylphenyl) tris(fluoranyl)methanesulfonate Openeye Name: (4-pentylphenyl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (4-pentylphenyl) ester IUPAC Name: (4-pentylphenyl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (4-amylphenyl) ester Formula: C12H15F3O3S MolecularWeight: 296.30591

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15F3O3S/c1-2-3-4-5-10-6-8-11(9-7-10)18-19(16,17)12(13,14)15/h6-9H,2-5H2,1H3