Structure Information
Structure

Compound Identification

SMILES

CC1=CC(COC2=C(C=C(Cl)C=C2C=NN2C(=O)C3C4CC(C=C4)C3C2=O)[N+]([O-])=O)=CC=C1

InChIKey

InChIKey=BWTWUCMTIBHKOC-UHFFFAOYSA-N

Formula

C24H20ClN3O5

Mass

465.89

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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 heteropolycyclic compounds

Substituents

Nitrophenyl ether - Isoindolone - Isoindoline - Isoindole or derivatives - Phenoxy compound - Nitroaromatic compound - Phenol ether - Chlorobenzene - Halobenzene - Alkyl aryl ether - Toluene - Aryl halide - 2-pyrrolidone - Pyrrolidone - Aryl chloride - Dicarboximide - Pyrrolidine - Organic nitro compound - Lactam - C-nitro compound - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxide - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Hydrocarbon derivative - Organic zwitterion - Organohalogen compound - Organic salt - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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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