N-(4-cyano-3-methyl-isoquinolin-1-yl)ethanamide

Systemtic Name: N-(4-cyano-3-methyl-isoquinolin-1-yl)ethanamide Openeye Name: N-(4-cyano-3-methyl-1-isoquinolyl)acetamide CAS Name: N-(4-cyano-3-methyl-1-isoquinolinyl)acetamide IUPAC Name: N-(4-cyano-3-methylisoquinolin-1-yl)acetamide Traditional Name: N-(4-cyano-3-methyl-1-isoquinolyl)acetamide Formula: C13H11N3O MolecularWeight: 225.24594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2C(=N1)NC(=O)C)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=C2C(=N1)NC(=O)C)C#N

InChI

InChI=1S/C13H11N3O/c1-8-12(7-14)10-5-3-4-6-11(10)13(15-8)16-9(2)17/h3-6H,1-2H3,(H,15,16,17)