Compound Identification
SMILES
O[C@@H]1[C@H](Cl)C=C(COC(=O)C2=CC=CC=C2)[C@@H](O)[C@@H]1OC(=O)C1=CC=CC=C1
InChIKey
InChIKey=QUOOWFYEPMIYFF-MKXGPGLRSA-N
Formula
C21H19ClO6
Mass
402.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
- Level 5 Benzoic acid esters
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Subclass
Benzoic acids and derivatives
-
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
Benzoyl derivatives Dicarboxylic acids and derivatives Cyclitols and derivatives Secondary alcohols Chlorohydrins Carboxylic acid esters Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Benzoate ester - Benzoyl - Cyclitol or derivatives - Dicarboxylic acid or derivatives - Secondary alcohol - Carboxylic acid ester - Chlorohydrin - Halohydrin - Carboxylic acid derivative - Alcohol - Organohalogen compound - Organochloride - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl chloride - Aromatic homomonocyclic 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