Compound Identification
SMILES
CC(=O)C1=CNC(=O)C2=CC3=C(OCO3)C=C12
InChIKey
InChIKey=IAMQVHJRNUPGGE-UHFFFAOYSA-N
Formula
C12H9NO4
Mass
231.207
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoquinolines and derivatives
- Subclass Isoquinolones and derivatives
-
Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Isoquinolones and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolones and derivatives
Alternative Parents
Benzodioxoles Aryl alkyl ketones Pyridinones Benzenoids Vinylogous amides Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Benzodioxole - Aryl ketone - Aryl alkyl ketone - Pyridinone - Pyridine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Ketone - Lactam - Acetal - Oxacycle - Azacycle - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Aldehyde - Organic oxygen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolones and derivatives. These are aromatic polycyclic compounds containing a ketone bearing isoquinoline moiety.
External Descriptors
Not available