2-[methyl(phenylmethoxycarbonyl)amino]-3-sulfanyl-propanoic acid

Systemtic Name: 2-[methyl(phenylmethoxycarbonyl)amino]-3-sulfanyl-propanoic acid Openeye Name: 2-[benzyloxycarbonyl(methyl)amino]-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[methyl(phenylmethoxycarbonyl)amino]propanoic acid IUPAC Name: 2-[methyl(phenylmethoxycarbonyl)amino]-3-sulfanylpropanoic acid Traditional Name: 2-[carbobenzoxy(methyl)amino]-3-mercapto-propionic acid Formula: C12H15NO4S MolecularWeight: 269.3168

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CS)C(=O)O)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CN(C(CS)C(=O)O)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C12H15NO4S/c1-13(10(8-18)11(14)15)12(16)17-7-9-5-3-2-4-6-9/h2-6,10,18H,7-8H2,1H3,(H,14,15)