Structure Information
Structure

Compound Identification

SMILES

BrC1=CN=CC(=C1)C(=O)N\N=C\C1=CC(Br)=CC(Br)=C1OC(=O)C1=CC2=C(OCO2)C=C1

InChIKey

InChIKey=ZOGSTZGNLMJRNN-MWRNPHMMSA-N

Formula

C21H12Br3N3O5

Mass

626.055

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol esters

Subclass

Not available

Intermediate Tree Nodes

Not available

Direct Parent

Phenol esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenol ester - Benzodioxole - Nicotinamide - Pyridine carboxylic acid or derivatives - Phenoxy compound - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyridine - Heteroaromatic compound - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenol esters. These are aromatic compounds containing a benzene ring substituted by a hydroxyl group and an ester group.

External Descriptors

Not available

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