2-methyl-3-(2-oxidanylidenepropyl)isoquinolin-1-one

Systemtic Name: 2-methyl-3-(2-oxidanylidenepropyl)isoquinolin-1-one Openeye Name: 3-acetonyl-2-methyl-isoquinolin-1-one CAS Name: 2-methyl-3-(2-oxopropyl)-1-isoquinolinone IUPAC Name: 2-methyl-3-(2-oxopropyl)isoquinolin-1-one Traditional Name: 3-acetonyl-2-methyl-isocarbostyril Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC1=CC2=CC=CC=C2C(=O)N1C

Isomeric SMILES

CC(=O)CC1=CC2=CC=CC=C2C(=O)N1C

InChI

InChI=1S/C13H13NO2/c1-9(15)7-11-8-10-5-3-4-6-12(10)13(16)14(11)2/h3-6,8H,7H2,1-2H3