2-acetamido-3-[[2-(hydroxymethyl)-5-oxidanylidene-cyclopentyl]methylsulfanyl]propanoic acid

Systemtic Name: 2-acetamido-3-[[2-(hydroxymethyl)-5-oxidanylidene-cyclopentyl]methylsulfanyl]propanoic acid Openeye Name: 2-acetamido-3-[[2-(hydroxymethyl)-5-oxo-cyclopentyl]methylsulfanyl]propanoic acid CAS Name: 2-acetamido-3-[[2-(hydroxymethyl)-5-oxocyclopentyl]methylthio]propanoic acid IUPAC Name: 2-acetamido-3-[[2-(hydroxymethyl)-5-oxocyclopentyl]methylsulfanyl]propanoic acid Traditional Name: 2-acetamido-3-[(2-keto-5-methylol-cyclopentyl)methylthio]propionic acid Formula: C12H19NO5S MolecularWeight: 289.34796

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CSCC1C(CCC1=O)CO)C(=O)O

Isomeric SMILES

CC(=O)NC(CSCC1C(CCC1=O)CO)C(=O)O

InChI

InChI=1S/C12H19NO5S/c1-7(15)13-10(12(17)18)6-19-5-9-8(4-14)2-3-11(9)16/h8-10,14H,2-6H2,1H3,(H,13,15)(H,17,18)