2,2-dimethyl-3-[(2-methylsulfanylphenyl)amino]propanoic acid

Systemtic Name: 2,2-dimethyl-3-[(2-methylsulfanylphenyl)amino]propanoic acid Openeye Name: 2,2-dimethyl-3-(2-methylsulfanylanilino)propanoic acid CAS Name: 2,2-dimethyl-3-[2-(methylthio)anilino]propanoic acid IUPAC Name: 2,2-dimethyl-3-(2-methylsulfanylanilino)propanoic acid Traditional Name: 2,2-dimethyl-3-[2-(methylthio)anilino]propionic acid Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC1=CC=CC=C1SC)C(=O)O

Isomeric SMILES

CC(C)(CNC1=CC=CC=C1SC)C(=O)O

InChI

InChI=1S/C12H17NO2S/c1-12(2,11(14)15)8-13-9-6-4-5-7-10(9)16-3/h4-7,13H,8H2,1-3H3,(H,14,15)