Compound Identification
SMILES
CC(O)=O.CCNC1=C(CNC(=O)C(OCC)N2CC3=C(C=C(Cl)C=C3)C2=O)C=CC(=C1)C(N)=N
InChIKey
InChIKey=ZLOGUBQNZZYJAQ-UHFFFAOYSA-N
Formula
C24H30ClN5O5
Mass
503.98
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Isoindoles and derivatives
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Subclass
Isoindolines
- Level 5 Isoindolones
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Subclass
Isoindolines
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Class
Isoindoles and derivatives
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoindoles and derivatives
Subclass
Isoindolines
Intermediate Tree Nodes
Not available
Direct Parent
Isoindolones
Alternative Parents
Alpha amino acids and derivatives Isoindoles Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Aryl chlorides Tertiary carboxylic acid amides Secondary carboxylic acid amides Lactams Monocarboxylic acids and derivatives Carboxylic acids Carboximidamides Carboxamidines Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Not available
Substituents
Alpha-amino acid or derivatives - Isoindolone - Isoindole - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Aryl chloride - Benzenoid - Aryl halide - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Amino acid or derivatives - Lactam - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid amidine - Secondary amine - Monocarboxylic acid or derivatives - Carboximidamide - Azacycle - Amidine - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoindolones. These are aromatic polycyclic compounds that an isoindole bearing a ketone.
External Descriptors
Not available