(2,5-dimethylcyclohexa-1,5-dien-1-yl) tris(fluoranyl)methanesulfonate

Systemtic Name: (2,5-dimethylcyclohexa-1,5-dien-1-yl) tris(fluoranyl)methanesulfonate Openeye Name: (2,5-dimethylcyclohexa-1,5-dien-1-yl) trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid (2,5-dimethyl-1-cyclohexa-1,5-dienyl) ester IUPAC Name: (2,5-dimethylcyclohexa-1,5-dien-1-yl) trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid (2,5-dimethylcyclohexa-1,5-dien-1-yl) ester Formula: C9H11F3O3S MolecularWeight: 256.24205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(CC1)C)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC1=CC(=C(CC1)C)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C9H11F3O3S/c1-6-3-4-7(2)8(5-6)15-16(13,14)9(10,11)12/h5H,3-4H2,1-2H3