Compound Identification
SMILES
ClC1=CC(Cl)=C(C=C1)C(=O)OCCN1C(=O)C2=CC=CC3=C(C=CC(C1=O)=C23)N1CCCCC1
InChIKey
InChIKey=MTZSXFGVTWMAKU-UHFFFAOYSA-N
Formula
C26H22Cl2N2O4
Mass
497.37
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
2-halobenzoic acids and derivatives 4-halobenzoic acids and derivatives Naphthalenes Benzoic acid esters Dichlorobenzenes Dialkylarylamines Benzoyl derivatives Piperidines N-substituted carboxylic acid imides Aryl chlorides Vinylogous halides Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organooxygen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinolone - Naphthalene - Benzoate ester - 2-halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - 1,3-dichlorobenzene - Benzoyl - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Chlorobenzene - Halobenzene - Benzenoid - Carboxylic acid imide, n-substituted - Piperidine - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Vinylogous halide - Carboxylic acid imide - Tertiary amine - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen 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