Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(C)OC1=C(OC)C=C(Br)C=C1C=NN1C(=O)C2C3CC(C=C3)C2C1=O

InChIKey

InChIKey=LZYWQBIAQHKTDA-UHFFFAOYSA-N

Formula

C21H21BrN2O6

Mass

477.311

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

2-phenoxypropionic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

2-phenoxypropionic acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenoxypropionic acid ester - Phenoxyacetate - Isoindolone - Isoindole or derivatives - Isoindoline - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - 2-pyrrolidone - Pyrrolidone - Methyl ester - Dicarboximide - Pyrrolidine - Lactam - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound

Description

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

External Descriptors

Not available

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