1-fluoranyloct-7-en-2-yl 2,4-dimethoxy-6-(trifluoromethylsulfonyloxy)benzoate

Systemtic Name: 1-fluoranyloct-7-en-2-yl 2,4-dimethoxy-6-(trifluoromethylsulfonyloxy)benzoate Openeye Name: 1-(fluoromethyl)hept-6-enyl 2,4-dimethoxy-6-(trifluoromethylsulfonyloxy)benzoate CAS Name: 2,4-dimethoxy-6-(trifluoromethylsulfonyloxy)benzoic acid 1-fluorooct-7-en-2-yl ester IUPAC Name: 1-fluorooct-7-en-2-yl 2,4-dimethoxy-6-(trifluoromethylsulfonyloxy)benzoate Traditional Name: 2,4-dimethoxy-6-triflyloxy-benzoic acid 1-(fluoromethyl)hept-6-enyl ester Formula: C18H22F4O7S MolecularWeight: 458.421693

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OS(=O)(=O)C(F)(F)F)C(=O)OC(CCCCC=C)CF)OC

Isomeric SMILES

COC1=CC(=C(C(=C1)OS(=O)(=O)C(F)(F)F)C(=O)OC(CCCCC=C)CF)OC

InChI

InChI=1S/C18H22F4O7S/c1-4-5-6-7-8-12(11-19)28-17(23)16-14(27-3)9-13(26-2)10-15(16)29-30(24,25)18(20,21)22/h4,9-10,12H,1,5-8,11H2,2-3H3