N-[4-(cyanomethyl)phenyl]-2-isoquinolin-3-yl-ethanamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-2-isoquinolin-3-yl-ethanamide Openeye Name: N-[4-(cyanomethyl)phenyl]-2-(3-isoquinolyl)acetamide CAS Name: N-[4-(cyanomethyl)phenyl]-2-(3-isoquinolinyl)acetamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-2-isoquinolin-3-ylacetamide Traditional Name: N-[4-(cyanomethyl)phenyl]-2-(3-isoquinolyl)acetamide Formula: C19H15N3O MolecularWeight: 301.3419

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)CC(=O)NC3=CC=C(C=C3)CC#N

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)CC(=O)NC3=CC=C(C=C3)CC#N

InChI

InChI=1S/C19H15N3O/c20-10-9-14-5-7-17(8-6-14)22-19(23)12-18-11-15-3-1-2-4-16(15)13-21-18/h1-8,11,13H,9,12H2,(H,22,23)