3-[(4-methylphenyl)sulfonylmethyl]-2,5-dihydropyran-6-one

Systemtic Name: 3-[(4-methylphenyl)sulfonylmethyl]-2,5-dihydropyran-6-one Openeye Name: 3-(p-tolylsulfonylmethyl)-2,5-dihydropyran-6-one CAS Name: 3-[(4-methylphenyl)sulfonylmethyl]-2,5-dihydropyran-6-one IUPAC Name: 3-[(4-methylphenyl)sulfonylmethyl]-2,5-dihydropyran-6-one Traditional Name: 3-(tosylmethyl)-2,5-dihydropyran-6-one Formula: C13H14O4S MolecularWeight: 266.31286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CC2=CCC(=O)OC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CC2=CCC(=O)OC2

InChI

InChI=1S/C13H14O4S/c1-10-2-5-12(6-3-10)18(15,16)9-11-4-7-13(14)17-8-11/h2-6H,7-9H2,1H3