Structure Information
Structure

Compound Identification

SMILES

COC(=O)[C@H](C)OC1=CC=C(NC2=C(C=C(C=C2)[N+]([O-])=O)[N+]([O-])=O)C=C1

InChIKey

InChIKey=XVTFHNDUFZUKDJ-JTQLQIEISA-N

Formula

C16H15N3O7

Mass

361.31

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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 homomonocyclic compounds

Substituents

2-phenoxypropionic acid ester - Dinitroaniline - Phenoxyacetate - Aminophenyl ether - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Aniline or substituted anilines - Phenol ether - Alkyl aryl ether - Primary aromatic amine - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Secondary amine - Organic salt - Hydrocarbon derivative - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Amine - Organic zwitterion - Aromatic homomonocyclic 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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