1-oxidanyl-5-tridecylsulfanyl-pentan-3-one

Systemtic Name: 1-oxidanyl-5-tridecylsulfanyl-pentan-3-one Openeye Name: 1-hydroxy-5-tridecylsulfanyl-pentan-3-one CAS Name: 1-hydroxy-5-(tridecylthio)-3-pentanone IUPAC Name: 1-hydroxy-5-tridecylsulfanylpentan-3-one Traditional Name: 1-hydroxy-5-(tridecylthio)pentan-3-one Formula: C18H36O2S MolecularWeight: 316.54224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCSCCC(=O)CCO

Isomeric SMILES

CCCCCCCCCCCCCSCCC(=O)CCO

InChI

InChI=1S/C18H36O2S/c1-2-3-4-5-6-7-8-9-10-11-12-16-21-17-14-18(20)13-15-19/h19H,2-17H2,1H3