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

Systemtic Name: 5-(3-bromanyl-4-methylperoxysulfanyl-phenyl)-2,2-dimethyl-4-phenyl-furan-3-one Openeye Name: 5-(3-bromo-4-methylperoxysulfanyl-phenyl)-2,2-dimethyl-4-phenyl-furan-3-one CAS Name: 2-bromo-4-(5,5-dimethyl-4-oxo-3-phenyl-2-furanyl)benzenesulfenic acid methoxy ester IUPAC Name: 5-(3-bromo-4-methylperoxysulfanylphenyl)-2,2-dimethyl-4-phenylfuran-3-one Traditional Name: 5-[3-bromo-4-(methylperoxythio)phenyl]-2,2-dimethyl-4-phenyl-furan-3-one Formula: C19H17BrO4S MolecularWeight: 421.30488

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C(=C(O1)C2=CC(=C(C=C2)SOOC)Br)C3=CC=CC=C3)C

Isomeric SMILES

CC1(C(=O)C(=C(O1)C2=CC(=C(C=C2)SOOC)Br)C3=CC=CC=C3)C

InChI

InChI=1S/C19H17BrO4S/c1-19(2)18(21)16(12-7-5-4-6-8-12)17(23-19)13-9-10-15(14(20)11-13)25-24-22-3/h4-11H,1-3H3