2-cyano-N-isoquinolin-5-yl-ethanamide

Systemtic Name: 2-cyano-N-isoquinolin-5-yl-ethanamide Openeye Name: 2-cyano-N-(5-isoquinolyl)acetamide CAS Name: 2-cyano-N-(5-isoquinolinyl)acetamide IUPAC Name: 2-cyano-N-isoquinolin-5-ylacetamide Traditional Name: 2-cyano-N-(5-isoquinolyl)acetamide Formula: C12H9N3O MolecularWeight: 211.21936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)CC#N

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)CC#N

InChI

InChI=1S/C12H9N3O/c13-6-4-12(16)15-11-3-1-2-9-8-14-7-5-10(9)11/h1-3,5,7-8H,4H2,(H,15,16)