2-[2-oxidanylidene-3-(sulfanylmethyl)piperidin-1-yl]ethanoic acid

Systemtic Name: 2-[2-oxidanylidene-3-(sulfanylmethyl)piperidin-1-yl]ethanoic acid Openeye Name: 2-[2-oxo-3-(sulfanylmethyl)-1-piperidyl]acetic acid CAS Name: 2-[3-(mercaptomethyl)-2-oxo-1-piperidinyl]acetic acid IUPAC Name: 2-[2-oxo-3-(sulfanylmethyl)piperidin-1-yl]acetic acid Traditional Name: 2-[2-keto-3-(mercaptomethyl)piperidino]acetic acid Formula: C8H13NO3S MolecularWeight: 203.25872

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)CC(=O)O)CS

Isomeric SMILES

C1CC(C(=O)N(C1)CC(=O)O)CS

InChI

InChI=1S/C8H13NO3S/c10-7(11)4-9-3-1-2-6(5-13)8(9)12/h6,13H,1-5H2,(H,10,11)