2-methyl-3-oxidanyl-5-(thian-3-yl)cyclohex-2-en-1-one

Systemtic Name: 2-methyl-3-oxidanyl-5-(thian-3-yl)cyclohex-2-en-1-one Openeye Name: 3-hydroxy-2-methyl-5-tetrahydrothiopyran-3-yl-cyclohex-2-en-1-one CAS Name: 3-hydroxy-2-methyl-5-(3-thianyl)-1-cyclohex-2-enone IUPAC Name: 3-hydroxy-2-methyl-5-(thian-3-yl)cyclohex-2-en-1-one Traditional Name: 3-hydroxy-2-methyl-5-tetrahydrothiopyran-3-yl-cyclohex-2-en-1-one Formula: C12H18O2S MolecularWeight: 226.33512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(CC1=O)C2CCCSC2)O

Isomeric SMILES

CC1=C(CC(CC1=O)C2CCCSC2)O

InChI

InChI=1S/C12H18O2S/c1-8-11(13)5-10(6-12(8)14)9-3-2-4-15-7-9/h9-10,13H,2-7H2,1H3