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

Systemtic Name: 3-(2-ethyl-1-oxidanylidene-3-phenyl-isoquinolin-4-yl)-N-methyl-propanamide Openeye Name: 3-(2-ethyl-1-oxo-3-phenyl-4-isoquinolyl)-N-methyl-propanamide CAS Name: 3-(2-ethyl-1-oxo-3-phenyl-4-isoquinolinyl)-N-methylpropanamide IUPAC Name: 3-(2-ethyl-1-oxo-3-phenylisoquinolin-4-yl)-N-methylpropanamide Traditional Name: 3-(2-ethyl-1-keto-3-phenyl-4-isoquinolyl)-N-methyl-propionamide Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC=CC=C2C1=O)CCC(=O)NC)C3=CC=CC=C3

Isomeric SMILES

CCN1C(=C(C2=CC=CC=C2C1=O)CCC(=O)NC)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O2/c1-3-23-20(15-9-5-4-6-10-15)17(13-14-19(24)22-2)16-11-7-8-12-18(16)21(23)25/h4-12H,3,13-14H2,1-2H3,(H,22,24)