5,5-dimethyl-4-(4-methylphenyl)sulfanyl-oxolan-2-one

Systemtic Name: 5,5-dimethyl-4-(4-methylphenyl)sulfanyl-oxolan-2-one Openeye Name: 5,5-dimethyl-4-(p-tolylsulfanyl)tetrahydrofuran-2-one CAS Name: 5,5-dimethyl-4-[(4-methylphenyl)thio]-2-oxolanone IUPAC Name: 5,5-dimethyl-4-(4-methylphenyl)sulfanyloxolan-2-one Traditional Name: 5,5-dimethyl-4-(p-tolylthio)tetrahydrofuran-2-one Formula: C13H16O2S MolecularWeight: 236.32994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2CC(=O)OC2(C)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2CC(=O)OC2(C)C

InChI

InChI=1S/C13H16O2S/c1-9-4-6-10(7-5-9)16-11-8-12(14)15-13(11,2)3/h4-7,11H,8H2,1-3H3