1-[4-(3-bromanylpropylsulfanyl)phenyl]butane-1,4-diol

Systemtic Name: 1-[4-(3-bromanylpropylsulfanyl)phenyl]butane-1,4-diol Openeye Name: 1-[4-(3-bromopropylsulfanyl)phenyl]butane-1,4-diol CAS Name: 1-[4-(3-bromopropylthio)phenyl]butane-1,4-diol IUPAC Name: 1-[4-(3-bromopropylsulfanyl)phenyl]butane-1,4-diol Traditional Name: 1-[4-(3-bromopropylthio)phenyl]butane-1,4-diol Formula: C13H19BrO2S MolecularWeight: 319.25776

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19BrO2S/c14-8-2-10-17-12-6-4-11(5-7-12)13(16)3-1-9-15/h4-7,13,15-16H,1-3,8-10H2