5-(2-oxidanylidenepropoxy)-2H-isoquinolin-1-one

Systemtic Name: 5-(2-oxidanylidenepropoxy)-2H-isoquinolin-1-one Openeye Name: 5-acetonyloxy-2H-isoquinolin-1-one CAS Name: 5-(2-oxopropoxy)-2H-isoquinolin-1-one IUPAC Name: 5-(2-oxopropoxy)-2H-isoquinolin-1-one Traditional Name: 5-acetonyloxyisocarbostyril Formula: C12H11NO3 MolecularWeight: 217.22064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC=CC2=C1C=CNC2=O

Isomeric SMILES

CC(=O)COC1=CC=CC2=C1C=CNC2=O

InChI

InChI=1S/C12H11NO3/c1-8(14)7-16-11-4-2-3-10-9(11)5-6-13-12(10)15/h2-6H,7H2,1H3,(H,13,15)