Structure Information
Structure

Compound Identification

SMILES

CC(OC1=CC=CC(=C1)C#CC1=NC2=C(C=CC(Br)=C2)C=C1)C(O)=O

InChIKey

InChIKey=RXVLXZIPUUHTEQ-UHFFFAOYSA-N

Formula

C20H14BrNO3

Mass

396.24

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

2-phenoxypropionic acids

Intermediate Tree Nodes

Not available

Direct Parent

2-phenoxypropionic acids

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenoxypropionic acid - Haloquinoline - Phenoxyacetate - Quinoline - Phenoxy compound - Phenol ether - Alkyl aryl ether - Aryl bromide - Aryl halide - Pyridine - Heteroaromatic compound - Azacycle - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organoheterocyclic compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as 2-phenoxypropionic acids. These are aromatic compounds hat contain a phenol ether attached to the C2-atom of a phenylpropionic acid.

External Descriptors

Not available

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