2-cinnolin-4-yl-2-phenyl-ethanenitrile

Systemtic Name: 2-cinnolin-4-yl-2-phenyl-ethanenitrile Openeye Name: 2-cinnolin-4-yl-2-phenyl-acetonitrile CAS Name: 2-(4-cinnolinyl)-2-phenylacetonitrile IUPAC Name: 2-cinnolin-4-yl-2-phenylacetonitrile Traditional Name: 2-cinnolin-4-yl-2-phenyl-acetonitrile Formula: C16H11N3 MolecularWeight: 245.27864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C#N)C2=CN=NC3=CC=CC=C32

Isomeric SMILES

C1=CC=C(C=C1)C(C#N)C2=CN=NC3=CC=CC=C32

InChI

InChI=1S/C16H11N3/c17-10-14(12-6-2-1-3-7-12)15-11-18-19-16-9-5-4-8-13(15)16/h1-9,11,14H