3-(2-hydroxyethylsulfanyl)-1-phenyl-butan-1-one

Systemtic Name: 3-(2-hydroxyethylsulfanyl)-1-phenyl-butan-1-one Openeye Name: 3-(2-hydroxyethylsulfanyl)-1-phenyl-butan-1-one CAS Name: 3-(2-hydroxyethylthio)-1-phenyl-1-butanone IUPAC Name: 3-(2-hydroxyethylsulfanyl)-1-phenylbutan-1-one Traditional Name: 3-(2-hydroxyethylthio)-1-phenyl-butan-1-one Formula: C12H16O2S MolecularWeight: 224.31924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)C1=CC=CC=C1)SCCO

Isomeric SMILES

CC(CC(=O)C1=CC=CC=C1)SCCO

InChI

InChI=1S/C12H16O2S/c1-10(15-8-7-13)9-12(14)11-5-3-2-4-6-11/h2-6,10,13H,7-9H2,1H3