Compound Identification
SMILES
CN1C=C(CCO)C(C(=O)NCC2=CC(Cl)=CC=C2)=C(OC(=O)C2=CC=CC=C2)C1=O
InChIKey
InChIKey=QKEKQJMUZXSNCE-UHFFFAOYSA-N
Formula
C23H21ClN2O5
Mass
440.88
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acid esters
Alternative Parents
Pyridinecarboxylic acids and derivatives Benzoyl derivatives Pyridinones Chlorobenzenes Dihydropyridines Aryl chlorides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Lactams Azacyclic compounds Organochlorides Organonitrogen compounds Organic oxides Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Pyridine carboxylic acid or derivatives - Benzoyl - Pyridinone - Chlorobenzene - Dihydropyridine - Halobenzene - Aryl chloride - Aryl halide - Pyridine - Hydropyridine - Heteroaromatic compound - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Lactam - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Organooxygen compound - Primary alcohol - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acid esters. These are ester derivatives of benzoic acid.
External Descriptors
Not available