Structure Information
Structure

Compound Identification

SMILES

CO\C=C(\C(=O)OC)C1=CC=CC=C1OC1=NC=NC(OC2=C(C=C(Cl)C=C2)C#N)=C1

InChIKey

InChIKey=CUJDXGQTUGMHRF-SFQUDFHCSA-N

Formula

C22H16ClN3O5

Mass

437.84

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenyl-beta-methoxyacrylates

Intermediate Tree Nodes

Not available

Direct Parent

Phenyl-beta-methoxyacrylates

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenyl-beta-methoxyacrylate - Diaryl ether - Phenoxy compound - Benzonitrile - Phenol ether - Styrene - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Pyrimidine - Heteroaromatic compound - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Methyl ester - Vinylogous ester - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Ether - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Cyanide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenyl-beta-methoxyacrylates. These are aromatic compounds containing a methyl-3-methoxyacrylate moiety that carries a benzyl group at the C-alpha carbon.

External Descriptors

Not available

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