2-(1-phenylpyrazol-4-yl)-2-piperidin-1-yl-ethanenitrile

Systemtic Name: 2-(1-phenylpyrazol-4-yl)-2-piperidin-1-yl-ethanenitrile Openeye Name: 2-(1-phenylpyrazol-4-yl)-2-(1-piperidyl)acetonitrile CAS Name: 2-(1-phenyl-4-pyrazolyl)-2-(1-piperidinyl)acetonitrile IUPAC Name: 2-(1-phenylpyrazol-4-yl)-2-piperidin-1-ylacetonitrile Traditional Name: 2-(1-phenylpyrazol-4-yl)-2-piperidino-acetonitrile Formula: C16H18N4 MolecularWeight: 266.34092

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(C#N)C2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)C(C#N)C2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C16H18N4/c17-11-16(19-9-5-2-6-10-19)14-12-18-20(13-14)15-7-3-1-4-8-15/h1,3-4,7-8,12-13,16H,2,5-6,9-10H2