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

Systemtic Name: 2-[4-(3-phenylpropanoyl)piperazin-1-yl]-2-pyridin-3-yl-ethanenitrile Openeye Name: 2-[4-(3-phenylpropanoyl)piperazin-1-yl]-2-(3-pyridyl)acetonitrile CAS Name: 2-[4-(1-oxo-3-phenylpropyl)-1-piperazinyl]-2-(3-pyridinyl)acetonitrile IUPAC Name: 2-[4-(3-phenylpropanoyl)piperazin-1-yl]-2-pyridin-3-ylacetonitrile Traditional Name: 2-(4-hydrocinnamoylpiperazino)-2-(3-pyridyl)acetonitrile Formula: C20H22N4O MolecularWeight: 334.41488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C#N)C2=CN=CC=C2)C(=O)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C(C#N)C2=CN=CC=C2)C(=O)CCC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O/c21-15-19(18-7-4-10-22-16-18)23-11-13-24(14-12-23)20(25)9-8-17-5-2-1-3-6-17/h1-7,10,16,19H,8-9,11-14H2