3-isoquinolin-3-yl-N-methyl-3-oxidanylidene-propanamide

Systemtic Name: 3-isoquinolin-3-yl-N-methyl-3-oxidanylidene-propanamide Openeye Name: 3-(3-isoquinolyl)-N-methyl-3-oxo-propanamide CAS Name: 3-(3-isoquinolinyl)-N-methyl-3-oxopropanamide IUPAC Name: 3-isoquinolin-3-yl-N-methyl-3-oxopropanamide Traditional Name: 3-(3-isoquinolyl)-3-keto-N-methyl-propionamide Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CC(=O)C1=CC2=CC=CC=C2C=N1

Isomeric SMILES

CNC(=O)CC(=O)C1=CC2=CC=CC=C2C=N1

InChI

InChI=1S/C13H12N2O2/c1-14-13(17)7-12(16)11-6-9-4-2-3-5-10(9)8-15-11/h2-6,8H,7H2,1H3,(H,14,17)