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

Systemtic Name: 2-methyl-5-(2-oxidanylidenepropoxy)isoquinolin-1-one Openeye Name: 5-acetonyloxy-2-methyl-isoquinolin-1-one CAS Name: 2-methyl-5-(2-oxopropoxy)-1-isoquinolinone IUPAC Name: 2-methyl-5-(2-oxopropoxy)isoquinolin-1-one Traditional Name: 5-acetonyloxy-2-methyl-isocarbostyril Formula: C13H13NO3 MolecularWeight: 231.24722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)COC1=CC=CC2=C1C=CN(C2=O)C

Isomeric SMILES

CC(=O)COC1=CC=CC2=C1C=CN(C2=O)C

InChI

InChI=1S/C13H13NO3/c1-9(15)8-17-12-5-3-4-11-10(12)6-7-14(2)13(11)16/h3-7H,8H2,1-2H3