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

Systemtic Name: 1-[4-(4-bromanylbutylsulfanyl)-2-oxidanyl-3-propyl-phenyl]ethanone Openeye Name: 1-[4-(4-bromobutylsulfanyl)-2-hydroxy-3-propyl-phenyl]ethanone CAS Name: 1-[4-(4-bromobutylthio)-2-hydroxy-3-propylphenyl]ethanone IUPAC Name: 1-[4-(4-bromobutylsulfanyl)-2-hydroxy-3-propylphenyl]ethanone Traditional Name: 1-[4-(4-bromobutylthio)-2-hydroxy-3-propyl-phenyl]ethanone Formula: C15H21BrO2S MolecularWeight: 345.29504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21BrO2S/c1-3-6-13-14(19-10-5-4-9-16)8-7-12(11(2)17)15(13)18/h7-8,18H,3-6,9-10H2,1-2H3