1-[4-(3-bromanylpropylsulfanyl)phenyl]-4-oxidanyl-butan-1-one

Systemtic Name: 1-[4-(3-bromanylpropylsulfanyl)phenyl]-4-oxidanyl-butan-1-one Openeye Name: 1-[4-(3-bromopropylsulfanyl)phenyl]-4-hydroxy-butan-1-one CAS Name: 1-[4-(3-bromopropylthio)phenyl]-4-hydroxy-1-butanone IUPAC Name: 1-[4-(3-bromopropylsulfanyl)phenyl]-4-hydroxybutan-1-one Traditional Name: 1-[4-(3-bromopropylthio)phenyl]-4-hydroxy-butan-1-one Formula: C13H17BrO2S MolecularWeight: 317.24188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CCCO)SCCCBr

Isomeric SMILES

C1=CC(=CC=C1C(=O)CCCO)SCCCBr

InChI

InChI=1S/C13H17BrO2S/c14-8-2-10-17-12-6-4-11(5-7-12)13(16)3-1-9-15/h4-7,15H,1-3,8-10H2