3-(2-fluoranyl-4-methylperoxysulfanyl-phenyl)-4-[4-(2-methylpropyl)phenyl]-2H-furan-5-one

Systemtic Name: 3-(2-fluoranyl-4-methylperoxysulfanyl-phenyl)-4-[4-(2-methylpropyl)phenyl]-2H-furan-5-one Openeye Name: 3-(2-fluoro-4-methylperoxysulfanyl-phenyl)-4-(4-isobutylphenyl)-2H-furan-5-one CAS Name: 3-fluoro-4-[4-[4-(2-methylpropyl)phenyl]-5-oxo-2H-furan-3-yl]benzenesulfenic acid methoxy ester IUPAC Name: 3-(2-fluoro-4-methylperoxysulfanylphenyl)-4-[4-(2-methylpropyl)phenyl]-2H-furan-5-one Traditional Name: 3-[2-fluoro-4-(methylperoxythio)phenyl]-4-(4-isobutylphenyl)-2H-furan-5-one Formula: C21H21FO4S MolecularWeight: 388.452443

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C2=C(COC2=O)C3=C(C=C(C=C3)SOOC)F

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C2=C(COC2=O)C3=C(C=C(C=C3)SOOC)F

InChI

InChI=1S/C21H21FO4S/c1-13(2)10-14-4-6-15(7-5-14)20-18(12-25-21(20)23)17-9-8-16(11-19(17)22)27-26-24-3/h4-9,11,13H,10,12H2,1-3H3