2-ethanoylsulfanyl-2-methyl-3-phenyl-propanoic acid

Systemtic Name: 2-ethanoylsulfanyl-2-methyl-3-phenyl-propanoic acid Openeye Name: 2-acetylsulfanyl-2-methyl-3-phenyl-propanoic acid CAS Name: 2-(acetylthio)-2-methyl-3-phenylpropanoic acid IUPAC Name: 2-acetylsulfanyl-2-methyl-3-phenylpropanoic acid Traditional Name: 2-(acetylthio)-2-methyl-3-phenyl-propionic acid Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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