5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-oxidanyl-furan-2-one

Systemtic Name: 5,5-dimethyl-4-(4-methylsulfonylphenyl)-3-oxidanyl-furan-2-one Openeye Name: 3-hydroxy-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one CAS Name: 3-hydroxy-5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-furanone IUPAC Name: 3-hydroxy-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one Traditional Name: 3-hydroxy-4-(4-mesylphenyl)-5,5-dimethyl-furan-2-one Formula: C13H14O5S MolecularWeight: 282.31226

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(=O)O1)O)C2=CC=C(C=C2)S(=O)(=O)C)C

Isomeric SMILES

CC1(C(=C(C(=O)O1)O)C2=CC=C(C=C2)S(=O)(=O)C)C

InChI

InChI=1S/C13H14O5S/c1-13(2)10(11(14)12(15)18-13)8-4-6-9(7-5-8)19(3,16)17/h4-7,14H,1-3H3