Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(C(C)=O)=C1N=C(NC(=O)C2=CC(C)=C(C=C2)[N+]([O-])=O)C2=CC=CC=C12

InChIKey

InChIKey=UWIRJDHFTCQFHW-UHFFFAOYSA-N

Formula

C21H17N3O6

Mass

407.382

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoindoles and derivatives

Subclass

Isoindoles

Intermediate Tree Nodes

Not available

Direct Parent

Isoindoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Benzoic acid or derivatives - M-toluamide - Toluamide - Isoindole - Nitrobenzene - Nitrotoluene - Nitroaromatic compound - Benzoyl - Beta-keto acid - Fatty acid ester - Toluene - Monocyclic benzene moiety - Keto acid - Fatty acyl - Benzenoid - Acryloyl-group - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Enone - Carboxylic acid ester - Ketone - C-nitro compound - Organic nitro compound - Organic oxoazanium - Carboxylic acid amidine - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Amidine - Azacycle - Carboxylic acid derivative - Carboximidamide - Organic 1,3-dipolar compound - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoindoles. These are heteropolycyclic compounds with a structure containing isoindole, a benzo-fused pyrrole.

External Descriptors

Not available

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