2-(dodecylsulfanylmethyl)-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: 2-(dodecylsulfanylmethyl)-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-(dodecylsulfanylmethyl)-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-[(dodecylthio)methyl]-3-hydroxy-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-(dodecylsulfanylmethyl)-3-hydroxy-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-hydroxy-2-[(laurylthio)methyl]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C21H38O2S MolecularWeight: 354.59022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSCC1=C(CC(CC1=O)(C)C)O

Isomeric SMILES

CCCCCCCCCCCCSCC1=C(CC(CC1=O)(C)C)O

InChI

InChI=1S/C21H38O2S/c1-4-5-6-7-8-9-10-11-12-13-14-24-17-18-19(22)15-21(2,3)16-20(18)23/h22H,4-17H2,1-3H3