methyl 2-[(4-methylsulfanylphenyl)carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl 2-[(4-methylsulfanylphenyl)carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl 3-hydroxy-2-[(4-methylsulfanylbenzoyl)amino]propanoate CAS Name: 3-hydroxy-2-[[[4-(methylthio)phenyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[(4-methylsulfanylbenzoyl)amino]propanoate Traditional Name: 3-hydroxy-2-[[4-(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=C(C=C1)SC

Isomeric SMILES

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

InChI

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