2-[4-(2-chloranylethanoyl)piperazin-1-yl]-2-pyridin-3-yl-ethanenitrile

Systemtic Name: 2-[4-(2-chloranylethanoyl)piperazin-1-yl]-2-pyridin-3-yl-ethanenitrile Openeye Name: 2-[4-(2-chloroacetyl)piperazin-1-yl]-2-(3-pyridyl)acetonitrile CAS Name: 2-[4-(2-chloro-1-oxoethyl)-1-piperazinyl]-2-(3-pyridinyl)acetonitrile IUPAC Name: 2-[4-(2-chloroacetyl)piperazin-1-yl]-2-pyridin-3-ylacetonitrile Traditional Name: 2-[4-(2-chloroacetyl)piperazino]-2-(3-pyridyl)acetonitrile Formula: C13H15ClN4O MolecularWeight: 278.7374

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C#N)C2=CN=CC=C2)C(=O)CCl

Isomeric SMILES

C1CN(CCN1C(C#N)C2=CN=CC=C2)C(=O)CCl

InChI

InChI=1S/C13H15ClN4O/c14-8-13(19)18-6-4-17(5-7-18)12(9-15)11-2-1-3-16-10-11/h1-3,10,12H,4-8H2