Compound Identification
SMILES
CN1N=C(C=C1N1C(=O)C2CC3N4N(CC=C3C(C3=CC=C(OCCO)C=C3)C2(C)C1=O)C(=O)N(C)C4=O)C1=C(C)C2=C(S1)C=CC(Cl)=C2
InChIKey
InChIKey=CRMFQULJMJVFLD-UHFFFAOYSA-N
Formula
C35H33ClN6O6S
Mass
701.2
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
1-benzothiophenes Phenoxy compounds Phenol ethers Urazoles Alkyl aryl ethers Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides Triazoles Thiophenes Pyrazoles Dicarboximides Heteroaromatic compounds Lactams Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organonitrogen compounds Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoindolone - 1-benzothiophene - Benzothiophene - Phenoxy compound - Phenol ether - Alkyl aryl ether - Urazole - Aryl chloride - Aryl halide - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Benzenoid - 2-pyrrolidone - Pyrrolidone - Azole - Pyrrolidine - Pyrazole - Thiophene - 1,2,4-triazole - Carboxylic acid imide - Dicarboximide - Heteroaromatic compound - Lactam - Azacycle - Carboxylic acid derivative - Ether - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Primary alcohol - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - 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