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

Systemtic Name: 2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(4-cyano-2-pyridyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-(4-cyano-2-pyridinyl)-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(4-cyanopyridin-2-yl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(4-cyano-2-pyridyl)piperazino]acetic acid Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C2=NC=CC(=C2)C#N

Isomeric SMILES

C1CN(CCN1CC(=O)O)C2=NC=CC(=C2)C#N

InChI

InChI=1S/C12H14N4O2/c13-8-10-1-2-14-11(7-10)16-5-3-15(4-6-16)9-12(17)18/h1-2,7H,3-6,9H2,(H,17,18)