Compound Identification
SMILES
COC1=C\C(C=CC1=O)=C(\NNC1=CC(Cl)=CC=C1)N=NC(=O)C1=CC2=CC=CC=C2OC1=O
InChIKey
InChIKey=OPQICSQONSXJNL-WYIGWTBXSA-N
Formula
C24H17ClN4O5
Mass
476.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Coumarins and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Coumarins and derivatives
Alternative Parents
1-benzopyrans Phenylhydrazines P-quinomethanes Pyranones and derivatives Chlorobenzenes Aryl chlorides Heteroaromatic compounds Azo compounds Ketene acetals Lactones Carboxylic acids and derivatives Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Hydrazines and derivatives Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumarin - 1-benzopyran - Benzopyran - P-quinomethane - Phenylhydrazine - Quinomethane - Pyranone - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Pyran - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Azo compound - Ketene acetal or derivatives - Lactone - Cyclic ketone - Ketone - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrazine derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as coumarins and derivatives. These are polycyclic aromatic compounds containing a 1-benzopyran moiety with a ketone group at the C2 carbon atom (1-benzopyran-2-one).
External Descriptors
Not available