Compound Identification
SMILES
C[C@H]1CCCC[C@H]1NC(=O)[C@H](N1C[C@]23O[C@@H](C=C2)[C@H]([C@H]3C1=O)C(=O)NC1=C(F)C=C(Br)C=C1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=HXISLEHWQJYIBE-KXEMDMISSA-N
Formula
C30H30BrClFN3O4
Mass
630.94
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
Alpha amino acids and derivatives Phenylacetamides Anilides Furopyrroles N-arylamides Bromobenzenes Chlorobenzenes Fluorobenzenes Pyrrolidine-2-ones Aryl bromides Aryl chlorides N-alkylpyrrolidines Aryl fluorides Tertiary carboxylic acid amides Furans Dihydrofurans Pyrroles Oxolanes Secondary carboxylic acid amides Lactams Azacyclic compounds Dialkyl ethers Oxacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Isoindolone - Phenylacetamide - Anilide - Furopyrrole - N-arylamide - Halobenzene - Fluorobenzene - Chlorobenzene - Bromobenzene - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Aryl halide - Aryl fluoride - Aryl chloride - Aryl bromide - Tertiary carboxylic acid amide - Dihydrofuran - Pyrrolidine - Furan - Pyrrole - Oxolane - Lactam - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Hydrocarbon derivative - Organochloride - Organofluoride - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Organic oxide - 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