Structure Information
Structure

Compound Identification

SMILES

COCC1=CC(C)=NC(NN=CC2=CC=C(O2)C2=C(OC)C=C(C=C2)[N+]([O-])=O)=C1C#N

InChIKey

InChIKey=HDEOQMNVTWYBOP-UHFFFAOYSA-N

Formula

C21H19N5O5

Mass

421.413

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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 heteromonocyclic compounds

Substituents

Nitrophenyl ether - Methoxyaniline - Phenoxy compound - Nitroaromatic compound - Anisole - Phenol ether - 3-pyridinecarbonitrile - Methoxybenzene - Alkyl aryl ether - Methylpyridine - Pyridine - Imidolactam - Furan - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Oxacycle - Organoheterocyclic compound - Azacycle - Dialkyl ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Ether - Hydrazone - Carbonitrile - Nitrile - Organic oxoazanium - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Cyanide - Organic oxide - Organopnictogen compound - Organic zwitterion - Organic salt - Hydrocarbon derivative - Aromatic heteromonocyclic 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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