N-methyl-3-(2-methyl-1-oxidanylidene-3-phenyl-isoquinolin-4-yl)propanamide

Systemtic Name: N-methyl-3-(2-methyl-1-oxidanylidene-3-phenyl-isoquinolin-4-yl)propanamide Openeye Name: N-methyl-3-(2-methyl-1-oxo-3-phenyl-4-isoquinolyl)propanamide CAS Name: N-methyl-3-(2-methyl-1-oxo-3-phenyl-4-isoquinolinyl)propanamide IUPAC Name: N-methyl-3-(2-methyl-1-oxo-3-phenylisoquinolin-4-yl)propanamide Traditional Name: 3-(1-keto-2-methyl-3-phenyl-4-isoquinolyl)-N-methyl-propionamide Formula: C20H20N2O2 MolecularWeight: 320.385

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CCC1=C(N(C(=O)C2=CC=CC=C21)C)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)CCC1=C(N(C(=O)C2=CC=CC=C21)C)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O2/c1-21-18(23)13-12-16-15-10-6-7-11-17(15)20(24)22(2)19(16)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3,(H,21,23)