[(E)-6,6,6-tris(fluoranyl)-2,2-dimethyl-5-phenyl-hex-4-en-3-yl] methanesulfonate

Systemtic Name: [(E)-6,6,6-tris(fluoranyl)-2,2-dimethyl-5-phenyl-hex-4-en-3-yl] methanesulfonate Openeye Name: [(E)-1-tert-butyl-4,4,4-trifluoro-3-phenyl-but-2-enyl] methanesulfonate CAS Name: methanesulfonic acid [(E)-6,6,6-trifluoro-2,2-dimethyl-5-phenylhex-4-en-3-yl] ester IUPAC Name: [(E)-6,6,6-trifluoro-2,2-dimethyl-5-phenylhex-4-en-3-yl] methanesulfonate Traditional Name: methanesulfonic acid [(E)-1-tert-butyl-4,4,4-trifluoro-3-phenyl-but-2-enyl] ester Formula: C15H19F3O3S MolecularWeight: 336.36977

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)(C)C(/C=C(\C1=CC=CC=C1)/C(F)(F)F)OS(=O)(=O)C

InChI

InChI=1S/C15H19F3O3S/c1-14(2,3)13(21-22(4,19)20)10-12(15(16,17)18)11-8-6-5-7-9-11/h5-10,13H,1-4H3/b12-10+