Compound Identification
SMILES
COC1=C(OC)C=C2C(=O)N(C)[C@H]3[C@H](C(=O)C4=CC5=C(OCO5)C=C34)C2=C1
InChIKey
InChIKey=XMGPGUJCNJAHRG-QZTJIDSGSA-N
Formula
C20H17NO6
Mass
367.357
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
Indanones Tetrahydroisoquinolines Benzodioxoles Anisoles Aryl alkyl ketones Alkyl aryl ethers Tertiary carboxylic acid amides Lactams Oxacyclic compounds Azacyclic compounds Acetals Organic oxides Hydrocarbon derivatives Aldehydes Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indanone - Isoquinolone - Tetrahydroisoquinoline - Benzodioxole - Indane - Anisole - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Benzenoid - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Lactam - Acetal - Carboxylic acid derivative - Ether - Oxacycle - Azacycle - Organic nitrogen compound - Aldehyde - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organonitrogen 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