4-[3-(hydroxymethyl)-4-methylperoxysulfanyl-phenyl]-5,5-dimethyl-3-propan-2-yloxy-furan-2-one

Systemtic Name: 4-[3-(hydroxymethyl)-4-methylperoxysulfanyl-phenyl]-5,5-dimethyl-3-propan-2-yloxy-furan-2-one Openeye Name: 4-[3-(hydroxymethyl)-4-methylperoxysulfanyl-phenyl]-3-isopropoxy-5,5-dimethyl-furan-2-one CAS Name: 4-(2,2-dimethyl-5-oxo-4-propan-2-yloxy-3-furanyl)-2-(hydroxymethyl)benzenesulfenic acid methoxy ester IUPAC Name: 4-[3-(hydroxymethyl)-4-methylperoxysulfanylphenyl]-5,5-dimethyl-3-propan-2-yloxyfuran-2-one Traditional Name: 3-isopropoxy-5,5-dimethyl-4-[3-methylol-4-(methylperoxythio)phenyl]furan-2-one Formula: C17H22O6S MolecularWeight: 354.41798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C(OC1=O)(C)C)C2=CC(=C(C=C2)SOOC)CO

Isomeric SMILES

CC(C)OC1=C(C(OC1=O)(C)C)C2=CC(=C(C=C2)SOOC)CO

InChI

InChI=1S/C17H22O6S/c1-10(2)21-15-14(17(3,4)22-16(15)19)11-6-7-13(24-23-20-5)12(8-11)9-18/h6-8,10,18H,9H2,1-5H3