Compound Identification
SMILES
COC1=NN=C(C=C1)N1C(=O)[C@H]2[C@H]3C[C@H](C=C3)[C@H]2C1=O
InChIKey
InChIKey=MSHNXRAUPZEPFG-IVQVNHIISA-N
Formula
C14H13N3O3
Mass
271.276
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
Alkyl aryl ethers Pyrrolidine-2-ones Pyridazines and derivatives N-substituted carboxylic acid imides Imidolactams Heteroaromatic compounds Dicarboximides Lactams Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoindolone - Alkyl aryl ether - Carboxylic acid imide, n-substituted - Pyridazine - Pyrrolidone - 2-pyrrolidone - Imidolactam - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Heteroaromatic compound - Lactam - Ether - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - 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