Structure Information
Structure

Compound Identification

SMILES

CCC(C)N(CC1=CC(OS(C)(=O)=O)=C(OC)C=C1)C(=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=WOEVTHXBGFMVGJ-UHFFFAOYSA-N

Formula

C20H24BrNO5S

Mass

470.38

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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

4-halobenzoic acids and derivatives

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

4-halobenzoic acid or derivatives - Benzamide - Benzoyl - Phenol ether - Phenoxy compound - Methoxybenzene - Anisole - Halobenzene - Bromobenzene - Alkyl aryl ether - Organosulfonic acid ester - Sulfonic acid ester - Aryl halide - Aryl bromide - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Methanesulfonate - Carboxamide group - Ether - Carboxylic acid derivative - Organobromide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as 4-halobenzoic acids and derivatives. These are benzoic acids or derivatives carrying a halogen atom at the 4-position of the benzene ring.

External Descriptors

Not available

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