3-cyano-N-isoquinolin-5-yl-benzamide

Systemtic Name: 3-cyano-N-isoquinolin-5-yl-benzamide Openeye Name: 3-cyano-N-(5-isoquinolyl)benzamide CAS Name: 3-cyano-N-(5-isoquinolinyl)benzamide IUPAC Name: 3-cyano-N-isoquinolin-5-ylbenzamide Traditional Name: 3-cyano-N-(5-isoquinolyl)benzamide Formula: C17H11N3O MolecularWeight: 273.28874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NC2=CC=CC3=C2C=CN=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NC2=CC=CC3=C2C=CN=C3)C#N

InChI

InChI=1S/C17H11N3O/c18-10-12-3-1-4-13(9-12)17(21)20-16-6-2-5-14-11-19-8-7-15(14)16/h1-9,11H,(H,20,21)