Structure Information
Structure

Compound Identification

SMILES

COC(=O)C(C)OC1=C(C=C(C=C2C(=O)NN(C2=O)C2=CC=CC=C2)C=C1Cl)[N+]([O-])=O

InChIKey

InChIKey=BNBOGBOYJKZOQU-UHFFFAOYSA-N

Formula

C20H16ClN3O7

Mass

445.81

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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 heteromonocyclic compounds

Substituents

2-phenoxypropionic acid ester - Nitrophenyl ether - Phenoxyacetate - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl halide - Aryl chloride - Pyrazolidinone - Pyrazolidine - Methyl ester - Organic nitro compound - Carboxylic acid ester - Carboxylic acid hydrazide - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Ether - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxoazanium - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic oxide - Organic cation - Aromatic heteromonocyclic 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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