Compound Identification
SMILES
COC1=C(OC)C=C(CCN2C(=O)[C@H]3[C@H]4C[C@H]([C@@H]5[C@@H]4ON=C5C([O-])=O)[C@@H]3C2=O)C=C1
InChIKey
InChIKey=BGTZBWJPVIPYKC-QANBLXNMSA-M
Formula
C21H21N2O7
Mass
413.407
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 Dimethoxybenzenes Phenoxy compounds Anisoles Alkyl aryl ethers Pyrrolidine-2-ones N-substituted carboxylic acid imides N-alkylpyrrolidines Dicarboximides Isoxazolines Oxime ethers Carboxylic acid salts Lactams Carboxylic acids Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Hydrocarbon derivatives Organopnictogen compounds Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aromatic monoterpenoid - Isoindolone - Norbornane monoterpenoid - Monoterpenoid - Dimethoxybenzene - O-dimethoxybenzene - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Carboxylic acid imide, n-substituted - Benzenoid - Monocyclic benzene moiety - N-alkylpyrrolidine - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide - Dicarboximide - Isoxazoline - Pyrrolidine - Oxime ether - Lactam - Carboxylic acid salt - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Ether - Carboxylic acid - Organopnictogen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Organic anion - 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