Compound Identification
SMILES
ClC1=CC=C(C=C1)C1CC(=NN1C1=CC=CC=C1)C1=C2C=CC=C3C(=O)N(C4=CC=CC=C4)C(=O)C(C=C1)=C23
InChIKey
InChIKey=HEJXMEUYQCJPHI-UHFFFAOYSA-N
Formula
C33H22ClN3O2
Mass
528.01
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
Naphthalenes Chlorobenzenes N-substituted carboxylic acid imides Aryl chlorides Pyrazolines Tertiary amines Amino acids and derivatives Hydrazones Azacyclic compounds Organooxygen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Naphthalene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Pyrazoline - Amino acid or derivatives - Tertiary amine - Hydrazone - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organohalogen 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