(1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 2-fluoranyl-4,5-dimethoxy-benzenesulfonate

Systemtic Name: (1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 2-fluoranyl-4,5-dimethoxy-benzenesulfonate Openeye Name: (1,7-dimethyl-3-oxo-indan-4-yl) 2-fluoro-4,5-dimethoxy-benzenesulfonate CAS Name: 2-fluoro-4,5-dimethoxybenzenesulfonic acid (1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (1,7-dimethyl-3-oxo-1,2-dihydroinden-4-yl) 2-fluoro-4,5-dimethoxybenzenesulfonate Traditional Name: 2-fluoro-4,5-dimethoxy-benzenesulfonic acid (3-keto-1,7-dimethyl-indan-4-yl) ester Formula: C19H19FO6S MolecularWeight: 394.413963

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)C3=C(C=C(C(=C3)OC)OC)F

Isomeric SMILES

CC1CC(=O)C2=C(C=CC(=C12)C)OS(=O)(=O)C3=C(C=C(C(=C3)OC)OC)F

InChI

InChI=1S/C19H19FO6S/c1-10-5-6-14(19-13(21)7-11(2)18(10)19)26-27(22,23)17-9-16(25-4)15(24-3)8-12(17)20/h5-6,8-9,11H,7H2,1-4H3