2-(4-pyridin-3-ylcarbonylpiperazin-1-yl)ethanenitrile

Systemtic Name: 2-(4-pyridin-3-ylcarbonylpiperazin-1-yl)ethanenitrile Openeye Name: 2-[4-(pyridine-3-carbonyl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-[oxo(3-pyridinyl)methyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(pyridine-3-carbonyl)piperazin-1-yl]acetonitrile Traditional Name: 2-(4-nicotinoylpiperazino)acetonitrile Formula: C12H14N4O MolecularWeight: 230.26576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14N4O/c13-3-5-15-6-8-16(9-7-15)12(17)11-2-1-4-14-10-11/h1-2,4,10H,5-9H2