1-[4-(5-bromanylpentylsulfanyl)-2-oxidanyl-3-propyl-phenyl]ethanone

Systemtic Name: 1-[4-(5-bromanylpentylsulfanyl)-2-oxidanyl-3-propyl-phenyl]ethanone Openeye Name: 1-[4-(5-bromopentylsulfanyl)-2-hydroxy-3-propyl-phenyl]ethanone CAS Name: 1-[4-(5-bromopentylthio)-2-hydroxy-3-propylphenyl]ethanone IUPAC Name: 1-[4-(5-bromopentylsulfanyl)-2-hydroxy-3-propylphenyl]ethanone Traditional Name: 1-[4-(5-bromopentylthio)-2-hydroxy-3-propyl-phenyl]ethanone Formula: C16H23BrO2S MolecularWeight: 359.32162

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)SCCCCCBr

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)SCCCCCBr

InChI

InChI=1S/C16H23BrO2S/c1-3-7-14-15(20-11-6-4-5-10-17)9-8-13(12(2)18)16(14)19/h8-9,19H,3-7,10-11H2,1-2H3