Structure Information
Structure

Compound Identification

SMILES

COC1=C(COC2=C(Cl)C=C(Br)C=C2)C=C(C=C1)[C@H]1[C@@H]2CCCC=C2C(C#N)=C(N)C1(C#N)C#N

InChIKey

InChIKey=CUSLXIGCUBZMSO-NLFFAJNJSA-N

Formula

C27H22BrClN4O2

Mass

549.85

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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 homopolycyclic compounds

Substituents

Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Enamine - Ether - Carbonitrile - Nitrile - Organobromide - Amine - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Cyanide - Primary aliphatic amine - Organic oxygen compound - Organohalogen compound - Aromatic homopolycyclic 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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