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1-[3-(butylsulfanylmethyl)-4-oxidanyl-phenyl]ethanone

1-[3-(butylsulfanylmethyl)-4-oxidanyl-phenyl]ethanone

Systemtic Name:1-[3-(butylsulfanylmethyl)-4-oxidanyl-phenyl]ethanone
Openeye Name:1-[3-(butylsulfanylmethyl)-4-hydroxy-phenyl]ethanone
CAS Name:1-[3-[(butylthio)methyl]-4-hydroxyphenyl]ethanone
IUPAC Name:1-[3-(butylsulfanylmethyl)-4-hydroxyphenyl]ethanone
Traditional Name:1-[3-[(butylthio)methyl]-4-hydroxy-phenyl]ethanone
Formula: C13H18O2S
MolecularWeight: 238.34582
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Descriptors Computed from Structure

Canonical SMILES:

CCCCSCC1=C(C=CC(=C1)C(=O)C)O


Isomeric SMILES

CCCCSCC1=C(C=CC(=C1)C(=O)C)O


InChI

InChI=1S/C13H18O2S/c1-3-4-7-16-9-12-8-11(10(2)14)5-6-13(12)15/h5-6,8,15H,3-4,7,9H2,1-2H3


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