2-chloranyl-N-(4,4-dimethyl-1-oxidanylidene-2,3-dihydroisoquinolin-7-yl)pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-(4,4-dimethyl-1-oxidanylidene-2,3-dihydroisoquinolin-7-yl)pyridine-3-carboxamide Openeye Name: 2-chloro-N-(4,4-dimethyl-1-oxo-2,3-dihydroisoquinolin-7-yl)pyridine-3-carboxamide CAS Name: 2-chloro-N-(4,4-dimethyl-1-oxo-2,3-dihydroisoquinolin-7-yl)-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-(4,4-dimethyl-1-oxo-2,3-dihydroisoquinolin-7-yl)pyridine-3-carboxamide Traditional Name: 2-chloro-N-(1-keto-4,4-dimethyl-2,3-dihydroisoquinolin-7-yl)nicotinamide Formula: C17H16ClN3O2 MolecularWeight: 329.78084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CNC(=O)C2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)C

Isomeric SMILES

CC1(CNC(=O)C2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)Cl)C

InChI

InChI=1S/C17H16ClN3O2/c1-17(2)9-20-15(22)12-8-10(5-6-13(12)17)21-16(23)11-4-3-7-19-14(11)18/h3-8H,9H2,1-2H3,(H,20,22)(H,21,23)