Compound Identification
SMILES
COC1=C(OC(=O)C2=CC=C(Cl)C=C2)C=CC(\C=N\NC2=NC(=O)C=C(C)N2)=C1
InChIKey
InChIKey=CTNHIIJCVRTANB-SSDVNMTOSA-N
Formula
C20H17ClN4O4
Mass
412.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
- Class Depsides and depsidones
-
Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Depsides and depsidones
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Depsides and depsidones
Alternative Parents
Phenol esters 4-halobenzoic acids and derivatives Benzoic acid esters Phenoxy compounds Methoxybenzenes Anisoles Benzoyl derivatives Pyrimidones Alkyl aryl ethers Chlorobenzenes Hydropyrimidines Aryl chlorides Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Hydrazones Azacyclic compounds Hydrocarbon derivatives Organochlorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Depside backbone - Benzoate ester - Phenol ester - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Phenoxy compound - Anisole - Methoxybenzene - Benzoyl - Phenol ether - Halobenzene - Chlorobenzene - Alkyl aryl ether - Pyrimidone - Monocyclic benzene moiety - Aryl chloride - Aryl halide - Pyrimidine - Hydropyrimidine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Hydrazone - Ether - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as depsides and depsidones. These are polycyclic compounds that is either a polyphenolic compound composed of two or more monocyclic aromatic units linked by an ester bond (depside), or a compound containing the depsidone structure (depsidone).
External Descriptors
Not available