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

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

Systemtic Name:1-[2-(cyanomethylsulfanyl)ethanoyl]pyrrolidine-2-carboxylic acid
Openeye Name:1-[2-(cyanomethylsulfanyl)acetyl]pyrrolidine-2-carboxylic acid
CAS Name:1-[2-(cyanomethylthio)-1-oxoethyl]-2-pyrrolidinecarboxylic acid
IUPAC Name:1-[2-(cyanomethylsulfanyl)acetyl]pyrrolidine-2-carboxylic acid
Traditional Name:1-[2-(cyanomethylthio)acetyl]proline
Formula: C9H12N2O3S
MolecularWeight: 228.26818
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CSCC#N)C(=O)O


Isomeric SMILES

C1CC(N(C1)C(=O)CSCC#N)C(=O)O


InChI

InChI=1S/C9H12N2O3S/c10-3-5-15-6-8(12)11-4-1-2-7(11)9(13)14/h7H,1-2,4-6H2,(H,13,14)


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