2-(piperidin-4-ylcarbonylamino)-3-sulfanyl-propanoic acid

Systemtic Name: 2-(piperidin-4-ylcarbonylamino)-3-sulfanyl-propanoic acid Openeye Name: 2-(piperidine-4-carbonylamino)-3-sulfanyl-propanoic acid CAS Name: 3-mercapto-2-[[oxo(4-piperidinyl)methyl]amino]propanoic acid IUPAC Name: 2-(piperidine-4-carbonylamino)-3-sulfanylpropanoic acid Traditional Name: 2-(isonipecotoylamino)-3-mercapto-propionic acid Formula: C9H16N2O3S MolecularWeight: 232.29994

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(=O)NC(CS)C(=O)O

Isomeric SMILES

C1CNCCC1C(=O)NC(CS)C(=O)O

InChI

InChI=1S/C9H16N2O3S/c12-8(6-1-3-10-4-2-6)11-7(5-15)9(13)14/h6-7,10,15H,1-5H2,(H,11,12)(H,13,14)