3-(carboxymethylsulfanyl)-2-(pyridin-3-ylcarbonylamino)propanoic acid

Systemtic Name: 3-(carboxymethylsulfanyl)-2-(pyridin-3-ylcarbonylamino)propanoic acid Openeye Name: 3-(carboxymethylsulfanyl)-2-(pyridine-3-carbonylamino)propanoic acid CAS Name: 3-(carboxymethylthio)-2-[[oxo(3-pyridinyl)methyl]amino]propanoic acid IUPAC Name: 3-(carboxymethylsulfanyl)-2-(pyridine-3-carbonylamino)propanoic acid Traditional Name: 3-(carboxymethylthio)-2-nicotinamido-propionic acid Formula: C11H12N2O5S MolecularWeight: 284.28838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C(=O)NC(CSCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CN=C1)C(=O)NC(CSCC(=O)O)C(=O)O

InChI

InChI=1S/C11H12N2O5S/c14-9(15)6-19-5-8(11(17)18)13-10(16)7-2-1-3-12-4-7/h1-4,8H,5-6H2,(H,13,16)(H,14,15)(H,17,18)