Compound Identification
SMILES
COC1=CC=CC=C1OCCC12CCC(C)(O1)C1C2C(=O)N(C1=O)C1=C(C#N)C2=CC=CC=C2C=C1
InChIKey
InChIKey=JTAVVFIHZLVWEU-UHFFFAOYSA-N
Formula
C29H26N2O5
Mass
482.536
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
Naphthalenes Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers Pyrrolidine-2-ones N-substituted carboxylic acid imides Oxolanes Dicarboximides Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Nitriles Organic oxides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoindolone - Naphthalene - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide - Dicarboximide - Oxolane - Pyrrolidine - Lactam - Azacycle - Nitrile - Carbonitrile - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Cyanide - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organooxygen compound - Organonitrogen 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