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
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenyl-beta-methoxyacrylates
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
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
Diarylethers Styrenes Phenoxy compounds Phenol ethers Benzonitriles Chlorobenzenes Aryl chlorides Pyrimidines and pyrimidine derivatives Vinylogous esters Enoate esters Heteroaromatic compounds Methyl esters Azacyclic compounds Nitriles Monocarboxylic acids and derivatives Organic oxides Organochlorides Hydrocarbon derivatives Carbonyl compounds
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