Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(F)C=CC(=C1)C(O)C1=NC=C(Br)C=C1

InChIKey

InChIKey=YGGXYQGEGWUHKU-UHFFFAOYSA-N

Formula

C14H11BrFNO3

Mass

340.148

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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

Not available

Direct Parent

Benzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoate ester - Halobenzoic acid or derivatives - 2-halobenzoic acid or derivatives - Benzoyl - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Pyridine - Heteroaromatic compound - Vinylogous halide - Methyl ester - Carboxylic acid ester - Secondary alcohol - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organohalogen compound - Organooxygen compound - Aromatic alcohol - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.

External Descriptors

Not available

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