methyl 2-[(2-methylsulfanylphenyl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[(2-methylsulfanylphenyl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2-[(2-methylsulfanylbenzoyl)amino]propanoate CAS Name: 3-hydroxy-2-[[[2-(methylthio)phenyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(2-methylsulfanylbenzoyl)amino]propanoate Traditional Name: 3-hydroxy-2-[[2-(methylthio)benzoyl]amino]propionic acid methyl ester Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CO)NC(=O)C1=CC=CC=C1SC

Isomeric SMILES

COC(=O)C(CO)NC(=O)C1=CC=CC=C1SC

InChI

InChI=1S/C12H15NO4S/c1-17-12(16)9(7-14)13-11(15)8-5-3-4-6-10(8)18-2/h3-6,9,14H,7H2,1-2H3,(H,13,15)