3-(3-ethanoylsulfanylphenyl)-2-methyl-propanoic acid

Systemtic Name: 3-(3-ethanoylsulfanylphenyl)-2-methyl-propanoic acid Openeye Name: 3-(3-acetylsulfanylphenyl)-2-methyl-propanoic acid CAS Name: 3-[3-(acetylthio)phenyl]-2-methylpropanoic acid IUPAC Name: 3-(3-acetylsulfanylphenyl)-2-methylpropanoic acid Traditional Name: 3-[3-(acetylthio)phenyl]-2-methyl-propionic acid Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC(=CC=C1)SC(=O)C)C(=O)O

Isomeric SMILES

CC(CC1=CC(=CC=C1)SC(=O)C)C(=O)O

InChI

InChI=1S/C12H14O3S/c1-8(12(14)15)6-10-4-3-5-11(7-10)16-9(2)13/h3-5,7-8H,6H2,1-2H3,(H,14,15)