Compound Identification
SMILES
C[C@H](OC(=O)C1=CC=C(C=C1)S(C)(=O)=O)C(=O)C1=CC2=C(CCC2)C=C1
InChIKey
InChIKey=FBAVXWCFXMZQBQ-ZDUSSCGKSA-N
Formula
C20H20O5S
Mass
372.44
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
Indanes Benzenesulfonyl compounds Benzoyl derivatives Aryl alkyl ketones Sulfones Carboxylic acid esters Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Benzoate ester - Benzenesulfonyl group - Indane - Benzoyl - Aryl alkyl ketone - Aryl ketone - Sulfonyl - Sulfone - Carboxylic acid ester - Ketone - Carboxylic acid derivative - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Aromatic homopolycyclic 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