2-[4-(2-cyanoethyl)piperazin-1-yl]-2-oxidanylidene-ethanoic acid

Systemtic Name: 2-[4-(2-cyanoethyl)piperazin-1-yl]-2-oxidanylidene-ethanoic acid Openeye Name: 2-[4-(2-cyanoethyl)piperazin-1-yl]-2-oxo-acetic acid CAS Name: 2-[4-(2-cyanoethyl)-1-piperazinyl]-2-oxoacetic acid IUPAC Name: 2-[4-(2-cyanoethyl)piperazin-1-yl]-2-oxoacetic acid Traditional Name: 2-[4-(2-cyanoethyl)piperazino]-2-keto-acetic acid Formula: C9H13N3O3 MolecularWeight: 211.21782

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC#N)C(=O)C(=O)O

Isomeric SMILES

C1CN(CCN1CCC#N)C(=O)C(=O)O

InChI

InChI=1S/C9H13N3O3/c10-2-1-3-11-4-6-12(7-5-11)8(13)9(14)15/h1,3-7H2,(H,14,15)