2-methyl-4-propanoyl-isoquinolin-1-one

Systemtic Name: 2-methyl-4-propanoyl-isoquinolin-1-one Openeye Name: 2-methyl-4-propanoyl-isoquinolin-1-one CAS Name: 2-methyl-4-(1-oxopropyl)-1-isoquinolinone IUPAC Name: 2-methyl-4-propanoylisoquinolin-1-one Traditional Name: 2-methyl-4-propionyl-isocarbostyril Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CN(C(=O)C2=CC=CC=C21)C

Isomeric SMILES

CCC(=O)C1=CN(C(=O)C2=CC=CC=C21)C

InChI

InChI=1S/C13H13NO2/c1-3-12(15)11-8-14(2)13(16)10-7-5-4-6-9(10)11/h4-8H,3H2,1-2H3