Structure Information
Structure

Compound Identification

SMILES

CCCCCCOC1=C(Br)C=C(C=C1)C(=O)NNC(=O)COC1=C(Br)C=C(Cl)C=C1

InChIKey

InChIKey=XQYOUZSQYIESKE-UHFFFAOYSA-N

Formula

C21H23Br2ClN2O4

Mass

562.68

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Halobenzoic acids and derivatives

Direct Parent

3-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

3-halobenzoic acid or derivatives - Benzoyl - Phenoxy compound - Phenol ether - Alkyl aryl ether - Bromobenzene - Chlorobenzene - Halobenzene - Aryl halide - Aryl bromide - Aryl chloride - Carboxylic acid hydrazide - Ether - Carboxylic acid derivative - Organohalogen compound - Organic oxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organobromide - Organochloride - Organonitrogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as 3-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 3-position of the benzene ring.

External Descriptors

Not available

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