1-[4-(4-oxidanylbutylsulfanyl)phenyl]ethanone

Systemtic Name: 1-[4-(4-oxidanylbutylsulfanyl)phenyl]ethanone Openeye Name: 1-[4-(4-hydroxybutylsulfanyl)phenyl]ethanone CAS Name: 1-[4-(4-hydroxybutylthio)phenyl]ethanone IUPAC Name: 1-[4-(4-hydroxybutylsulfanyl)phenyl]ethanone Traditional Name: 1-[4-(4-hydroxybutylthio)phenyl]ethanone Formula: C12H16O2S MolecularWeight: 224.31924

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)SCCCCO

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)SCCCCO

InChI

InChI=1S/C12H16O2S/c1-10(14)11-4-6-12(7-5-11)15-9-3-2-8-13/h4-7,13H,2-3,8-9H2,1H3