Compound Identification
SMILES
ClC1=CC=CC=C1NC(=O)CCCCCN1C(=O)[C@H]2[C@@H]3C[C@H]([C@@H](Br)[C@H]3Br)[C@H]2C1=O
InChIKey
InChIKey=GTWPKQTUKNICGD-NCVBHOKTSA-N
Formula
C21H23Br2ClN2O3
Mass
546.68
Taxonomic Classification
Taxonomy Tree
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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
Aromatic monoterpenoids Anilides N-arylamides Chlorobenzenes Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides N-alkylpyrrolidines Fatty amides Dicarboximides Secondary carboxylic acid amides Lactams Azacyclic compounds Carbonyl compounds Alkyl bromides Organic oxides Organobromides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aromatic monoterpenoid - Monoterpenoid - Isoindolone - Norbornane monoterpenoid - Anilide - N-arylamide - Chlorobenzene - Halobenzene - Aryl halide - Fatty acyl - Benzenoid - N-alkylpyrrolidine - Carboxylic acid imide, n-substituted - Aryl chloride - 2-pyrrolidone - Pyrrolidone - Fatty amide - Monocyclic benzene moiety - Pyrrolidine - Carboxylic acid imide - Dicarboximide - Secondary carboxylic acid amide - Lactam - Carboxamide group - Azacycle - Carboxylic acid derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Alkyl halide - Alkyl bromide - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organobromide - Organohalogen 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