2-[4-(2-phenylethanoyl)piperazin-1-yl]ethanenitrile

Systemtic Name: 2-[4-(2-phenylethanoyl)piperazin-1-yl]ethanenitrile Openeye Name: 2-[4-(2-phenylacetyl)piperazin-1-yl]acetonitrile CAS Name: 2-[4-(1-oxo-2-phenylethyl)-1-piperazinyl]acetonitrile IUPAC Name: 2-[4-(2-phenylacetyl)piperazin-1-yl]acetonitrile Traditional Name: 2-[4-(2-phenylacetyl)piperazino]acetonitrile Formula: C14H17N3O MolecularWeight: 243.30428

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#N)C(=O)CC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CC#N)C(=O)CC2=CC=CC=C2

InChI

InChI=1S/C14H17N3O/c15-6-7-16-8-10-17(11-9-16)14(18)12-13-4-2-1-3-5-13/h1-5H,7-12H2