1-[4-(3-chloranylpropylsulfanyl)-3-methoxy-phenyl]ethanone

Systemtic Name: 1-[4-(3-chloranylpropylsulfanyl)-3-methoxy-phenyl]ethanone Openeye Name: 1-[4-(3-chloropropylsulfanyl)-3-methoxy-phenyl]ethanone CAS Name: 1-[4-(3-chloropropylthio)-3-methoxyphenyl]ethanone IUPAC Name: 1-[4-(3-chloropropylsulfanyl)-3-methoxyphenyl]ethanone Traditional Name: 1-[4-(3-chloropropylthio)-3-methoxy-phenyl]ethanone Formula: C12H15ClO2S MolecularWeight: 258.7643

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)SCCCCl)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)SCCCCl)OC

InChI

InChI=1S/C12H15ClO2S/c1-9(14)10-4-5-12(11(8-10)15-2)16-7-3-6-13/h4-5,8H,3,6-7H2,1-2H3