2-[(4-methylsulfanylphenyl)carbonylamino]-3-oxidanyl-propanoic acid

Systemtic Name: 2-[(4-methylsulfanylphenyl)carbonylamino]-3-oxidanyl-propanoic acid Openeye Name: 3-hydroxy-2-[(4-methylsulfanylbenzoyl)amino]propanoic acid CAS Name: 3-hydroxy-2-[[[4-(methylthio)phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-hydroxy-2-[(4-methylsulfanylbenzoyl)amino]propanoic acid Traditional Name: 3-hydroxy-2-[[4-(methylthio)benzoyl]amino]propionic acid Formula: C11H13NO4S MolecularWeight: 255.29022

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)NC(CO)C(=O)O

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)NC(CO)C(=O)O

InChI

InChI=1S/C11H13NO4S/c1-17-8-4-2-7(3-5-8)10(14)12-9(6-13)11(15)16/h2-5,9,13H,6H2,1H3,(H,12,14)(H,15,16)