N-[4-[2-(3-fluoranyl-4-methylperoxysulfanyl-phenyl)-5,5-dimethyl-4-oxidanylidene-furan-3-yl]phenyl]ethanamide

Systemtic Name: N-[4-[2-(3-fluoranyl-4-methylperoxysulfanyl-phenyl)-5,5-dimethyl-4-oxidanylidene-furan-3-yl]phenyl]ethanamide Openeye Name: N-[4-[2-(3-fluoro-4-methylperoxysulfanyl-phenyl)-5,5-dimethyl-4-oxo-3-furyl]phenyl]acetamide CAS Name: 4-[3-(4-acetamidophenyl)-5,5-dimethyl-4-oxo-2-furanyl]-2-fluorobenzenesulfenic acid methoxy ester IUPAC Name: N-[4-[2-(3-fluoro-4-methylperoxysulfanylphenyl)-5,5-dimethyl-4-oxofuran-3-yl]phenyl]acetamide Traditional Name: N-[4-[2-[3-fluoro-4-(methylperoxythio)phenyl]-4-keto-5,5-dimethyl-3-furyl]phenyl]acetamide Formula: C21H20FNO5S MolecularWeight: 417.450603

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C2=C(OC(C2=O)(C)C)C3=CC(=C(C=C3)SOOC)F

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C2=C(OC(C2=O)(C)C)C3=CC(=C(C=C3)SOOC)F

InChI

InChI=1S/C21H20FNO5S/c1-12(24)23-15-8-5-13(6-9-15)18-19(27-21(2,3)20(18)25)14-7-10-17(16(22)11-14)29-28-26-4/h5-11H,1-4H3,(H,23,24)