3-(4-fluorophenyl)-5,5-dimethyl-4-(3-methyl-4-methylperoxysulfanyl-phenyl)furan-2-one

Systemtic Name: 3-(4-fluorophenyl)-5,5-dimethyl-4-(3-methyl-4-methylperoxysulfanyl-phenyl)furan-2-one Openeye Name: 3-(4-fluorophenyl)-5,5-dimethyl-4-(3-methyl-4-methylperoxysulfanyl-phenyl)furan-2-one CAS Name: 4-[4-(4-fluorophenyl)-2,2-dimethyl-5-oxo-3-furanyl]-2-methylbenzenesulfenic acid methoxy ester IUPAC Name: 3-(4-fluorophenyl)-5,5-dimethyl-4-(3-methyl-4-methylperoxysulfanylphenyl)furan-2-one Traditional Name: 3-(4-fluorophenyl)-5,5-dimethyl-4-[3-methyl-4-(methylperoxythio)phenyl]furan-2-one Formula: C20H19FO4S MolecularWeight: 374.425863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=C(C(=O)OC2(C)C)C3=CC=C(C=C3)F)SOOC

Isomeric SMILES

CC1=C(C=CC(=C1)C2=C(C(=O)OC2(C)C)C3=CC=C(C=C3)F)SOOC

InChI

InChI=1S/C20H19FO4S/c1-12-11-14(7-10-16(12)26-25-23-4)18-17(19(22)24-20(18,2)3)13-5-8-15(21)9-6-13/h5-11H,1-4H3