Structure Information
Structure

Compound Identification

SMILES

CC1=C(OCC2=CC=CC=C2)C(=C(C=C1)C(=O)NCCCCCC([O-])=O)[N+]([O-])=O

InChIKey

InChIKey=AJUYTJMRFKEKNJ-UHFFFAOYSA-M

Formula

C21H23N2O6

Mass

399.424

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrophenyl ethers

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Nitrophenyl ether - Nitro fatty acid - Nitrotoluene - Toluamide - P-toluamide - Benzoic acid or derivatives - Benzamide - Phenol ether - Benzoyl - Medium-chain fatty acid - Nitroaromatic compound - Phenoxy compound - Toluene - Alkyl aryl ether - Fatty acyl - Fatty acid - Organic nitro compound - C-nitro compound - Carboxamide group - Carboxylic acid salt - Secondary carboxylic acid amide - Carboxylic acid derivative - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic nitrogen compound - Organic salt - Carbonyl group - Organic oxygen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrophenyl ethers. These are aromatic compounds containing a nitrobenzene moiety that carries an ether group on the benzene ring.

External Descriptors

Not available

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