1-[5-chloranyl-2-oxidanyl-3-(propylsulfanylmethyl)phenyl]ethanone

Systemtic Name: 1-[5-chloranyl-2-oxidanyl-3-(propylsulfanylmethyl)phenyl]ethanone Openeye Name: 1-[5-chloro-2-hydroxy-3-(propylsulfanylmethyl)phenyl]ethanone CAS Name: 1-[5-chloro-2-hydroxy-3-[(propylthio)methyl]phenyl]ethanone IUPAC Name: 1-[5-chloro-2-hydroxy-3-(propylsulfanylmethyl)phenyl]ethanone Traditional Name: 1-[5-chloro-2-hydroxy-3-[(propylthio)methyl]phenyl]ethanone Formula: C12H15ClO2S MolecularWeight: 258.7643

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Descriptors Computed from Structure

Canonical SMILES:

CCCSCC1=C(C(=CC(=C1)Cl)C(=O)C)O

Isomeric SMILES

CCCSCC1=C(C(=CC(=C1)Cl)C(=O)C)O

InChI

InChI=1S/C12H15ClO2S/c1-3-4-16-7-9-5-10(13)6-11(8(2)14)12(9)15/h5-6,15H,3-4,7H2,1-2H3