Compound Identification
SMILES
CC(C)OC(=O)C(C(=O)OC(C)C)=C1SCC(OC(=O)C2=CC=CC=C2C(O)=O)S1
InChIKey
InChIKey=XPCPCLOEBUMUSS-UHFFFAOYSA-N
Formula
C20H22O8S2
Mass
454.51
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
Benzoic acids Benzoyl derivatives Vinylogous thioesters Dicarboxylic acids and derivatives Monothioacetals Enoate esters 1,3-dithiolanes Ketene acetals Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzoate ester - Benzoic acid - Benzoyl - Vinylogous thioester - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated carboxylic ester - Enoate ester - 1,3-dithiolane - Dithiolane - Monothioacetal - Carboxylic acid ester - Ketene acetal or derivatives - Organoheterocyclic compound - Carboxylic acid - Carboxylic acid derivative - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organic oxygen 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