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

Systemtic Name: (1,7-dimethyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 2-chloranyl-4-fluoranyl-benzenesulfonate Openeye Name: (1,7-dimethyl-3-oxo-indan-4-yl) 2-chloro-4-fluoro-benzenesulfonate CAS Name: 2-chloro-4-fluorobenzenesulfonic 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-chloro-4-fluorobenzenesulfonate Traditional Name: 2-chloro-4-fluoro-benzenesulfonic acid (3-keto-1,7-dimethyl-indan-4-yl) ester Formula: C17H14ClFO4S MolecularWeight: 368.807063

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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)F)Cl

Isomeric SMILES

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

InChI

InChI=1S/C17H14ClFO4S/c1-9-3-5-14(17-13(20)7-10(2)16(9)17)23-24(21,22)15-6-4-11(19)8-12(15)18/h3-6,8,10H,7H2,1-2H3