1-[2-(cyanomethylsulfanyl)ethanoyl]piperidine-2-carboxylic acid

Systemtic Name: 1-[2-(cyanomethylsulfanyl)ethanoyl]piperidine-2-carboxylic acid Openeye Name: 1-[2-(cyanomethylsulfanyl)acetyl]piperidine-2-carboxylic acid CAS Name: 1-[2-(cyanomethylthio)-1-oxoethyl]-2-piperidinecarboxylic acid IUPAC Name: 1-[2-(cyanomethylsulfanyl)acetyl]piperidine-2-carboxylic acid Traditional Name: 1-[2-(cyanomethylthio)acetyl]pipecolinic acid Formula: C10H14N2O3S MolecularWeight: 242.29476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)O)C(=O)CSCC#N

Isomeric SMILES

C1CCN(C(C1)C(=O)O)C(=O)CSCC#N

InChI

InChI=1S/C10H14N2O3S/c11-4-6-16-7-9(13)12-5-2-1-3-8(12)10(14)15/h8H,1-3,5-7H2,(H,14,15)