2-[(1S,6R)-1,6-dimethyl-2-(trifluoromethylsulfonyloxy)cyclohex-2-en-1-yl]ethanoic acid

Systemtic Name: 2-[(1S,6R)-1,6-dimethyl-2-(trifluoromethylsulfonyloxy)cyclohex-2-en-1-yl]ethanoic acid Openeye Name: 2-[(1S,6R)-1,6-dimethyl-2-(trifluoromethylsulfonyloxy)cyclohex-2-en-1-yl]acetic acid CAS Name: 2-[(1S,6R)-1,6-dimethyl-2-(trifluoromethylsulfonyloxy)-1-cyclohex-2-enyl]acetic acid IUPAC Name: 2-[(1S,6R)-1,6-dimethyl-2-(trifluoromethylsulfonyloxy)cyclohex-2-en-1-yl]acetic acid Traditional Name: 2-[(1S,6R)-1,6-dimethyl-2-triflyloxy-cyclohex-2-en-1-yl]acetic acid Formula: C11H15F3O5S MolecularWeight: 316.29401

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC=C(C1(C)CC(=O)O)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

C[C@@H]1CCC=C([C@@]1(C)CC(=O)O)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C11H15F3O5S/c1-7-4-3-5-8(10(7,2)6-9(15)16)19-20(17,18)11(12,13)14/h5,7H,3-4,6H2,1-2H3,(H,15,16)/t7-,10+/m1/s1