2-chloranyl-N-(isoquinolin-1-ylmethyl)pyridine-4-carboxamide

Systemtic Name: 2-chloranyl-N-(isoquinolin-1-ylmethyl)pyridine-4-carboxamide Openeye Name: 2-chloro-N-(1-isoquinolylmethyl)pyridine-4-carboxamide CAS Name: 2-chloro-N-(1-isoquinolinylmethyl)-4-pyridinecarboxamide IUPAC Name: 2-chloro-N-(isoquinolin-1-ylmethyl)pyridine-4-carboxamide Traditional Name: 2-chloro-N-(1-isoquinolylmethyl)isonicotinamide Formula: C16H12ClN3O MolecularWeight: 297.73898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2CNC(=O)C3=CC(=NC=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2CNC(=O)C3=CC(=NC=C3)Cl

InChI

InChI=1S/C16H12ClN3O/c17-15-9-12(6-8-19-15)16(21)20-10-14-13-4-2-1-3-11(13)5-7-18-14/h1-9H,10H2,(H,20,21)