3-[3-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinolin-4-yl]-N-methyl-propanamide

Systemtic Name: 3-[3-(4-chlorophenyl)-2-methyl-1-oxidanylidene-isoquinolin-4-yl]-N-methyl-propanamide Openeye Name: 3-[3-(4-chlorophenyl)-2-methyl-1-oxo-4-isoquinolyl]-N-methyl-propanamide CAS Name: 3-[3-(4-chlorophenyl)-2-methyl-1-oxo-4-isoquinolinyl]-N-methylpropanamide IUPAC Name: 3-[3-(4-chlorophenyl)-2-methyl-1-oxoisoquinolin-4-yl]-N-methylpropanamide Traditional Name: 3-[3-(4-chlorophenyl)-1-keto-2-methyl-4-isoquinolyl]-N-methyl-propionamide Formula: C20H19ClN2O2 MolecularWeight: 354.83006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19ClN2O2/c1-22-18(24)12-11-16-15-5-3-4-6-17(15)20(25)23(2)19(16)13-7-9-14(21)10-8-13/h3-10H,11-12H2,1-2H3,(H,22,24)