3-(4-fluorophenyl)-5,5-dimethyl-4-[4-methylperoxysulfanyl-3-(oxan-4-yl)phenyl]furan-2-one

Systemtic Name: 3-(4-fluorophenyl)-5,5-dimethyl-4-[4-methylperoxysulfanyl-3-(oxan-4-yl)phenyl]furan-2-one Openeye Name: 3-(4-fluorophenyl)-5,5-dimethyl-4-(4-methylperoxysulfanyl-3-tetrahydropyran-4-yl-phenyl)furan-2-one CAS Name: 4-[4-(4-fluorophenyl)-2,2-dimethyl-5-oxo-3-furanyl]-2-(4-oxanyl)benzenesulfenic acid methoxy ester IUPAC Name: 3-(4-fluorophenyl)-5,5-dimethyl-4-[4-methylperoxysulfanyl-3-(oxan-4-yl)phenyl]furan-2-one Traditional Name: 3-(4-fluorophenyl)-5,5-dimethyl-4-[4-(methylperoxythio)-3-tetrahydropyran-4-yl-phenyl]furan-2-one Formula: C24H25FO5S MolecularWeight: 444.515703

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)O1)C2=CC=C(C=C2)F)C3=CC(=C(C=C3)SOOC)C4CCOCC4)C

Isomeric SMILES

CC1(C(=C(C(=O)O1)C2=CC=C(C=C2)F)C3=CC(=C(C=C3)SOOC)C4CCOCC4)C

InChI

InChI=1S/C24H25FO5S/c1-24(2)22(21(23(26)29-24)16-4-7-18(25)8-5-16)17-6-9-20(31-30-27-3)19(14-17)15-10-12-28-13-11-15/h4-9,14-15H,10-13H2,1-3H3