[2-(3,7-dimethyloct-6-enoyl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [2-(3,7-dimethyloct-6-enoyl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [2-(3,7-dimethyloct-6-enoyl)phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [2-(3,7-dimethyl-1-oxooct-6-enyl)phenyl] ester IUPAC Name: [2-(3,7-dimethyloct-6-enoyl)phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [2-(3,7-dimethyloct-6-enoyl)phenyl] ester Formula: C17H21F3O4S MolecularWeight: 378.40645

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC=C(C)C)CC(=O)C1=CC=CC=C1OS(=O)(=O)C(F)(F)F

Isomeric SMILES

CC(CCC=C(C)C)CC(=O)C1=CC=CC=C1OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C17H21F3O4S/c1-12(2)7-6-8-13(3)11-15(21)14-9-4-5-10-16(14)24-25(22,23)17(18,19)20/h4-5,7,9-10,13H,6,8,11H2,1-3H3