Structure Information
Structure

Compound Identification

SMILES

COC1=C(Br)C=C(C=C1)C1OC23CCCCCCC2C(C#N)(C(=N)O3)C1(C#N)C#N

InChIKey

InChIKey=OKUDQKHLXZPDAS-UHFFFAOYSA-N

Formula

C22H21BrN4O3

Mass

469.339

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Phenol ethers

Subclass

Anisoles

Intermediate Tree Nodes

Not available

Direct Parent

Anisoles

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Phenoxy compound - Anisole - Methoxybenzene - 1,3-dioxepane - Alkyl aryl ether - Bromobenzene - Ketal - Dioxepane - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Oxane - Oxolane - Imido ester - Organoheterocyclic compound - Acetal - Nitrile - Carbonitrile - Oxacycle - Ether - Organonitrogen compound - Hydrocarbon derivative - Cyanide - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organooxygen compound - Organopnictogen compound - Organobromide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.

External Descriptors

Not available

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