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

Systemtic Name: 1-[3-(2-methylpropylsulfanylmethyl)-4-oxidanyl-phenyl]ethanone Openeye Name: 1-[4-hydroxy-3-(isobutylsulfanylmethyl)phenyl]ethanone CAS Name: 1-[4-hydroxy-3-[(2-methylpropylthio)methyl]phenyl]ethanone IUPAC Name: 1-[4-hydroxy-3-(2-methylpropylsulfanylmethyl)phenyl]ethanone Traditional Name: 1-[4-hydroxy-3-[(isobutylthio)methyl]phenyl]ethanone Formula: C13H18O2S MolecularWeight: 238.34582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSCC1=C(C=CC(=C1)C(=O)C)O

Isomeric SMILES

CC(C)CSCC1=C(C=CC(=C1)C(=O)C)O

InChI

InChI=1S/C13H18O2S/c1-9(2)7-16-8-12-6-11(10(3)14)4-5-13(12)15/h4-6,9,15H,7-8H2,1-3H3