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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)O)CSC(C)(C)C

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)O)CSC(C)(C)C

InChI

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