Compound Identification
SMILES
CCOC(=O)C(C)CC(=O)OC1=CC=CC=C1C(=O)NC1=NC(C(=O)OC)=C(S1)S(C)(=O)=O
InChIKey
InChIKey=VWJCRDQBWRQLTN-UHFFFAOYSA-N
Formula
C20H22N2O9S2
Mass
498.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
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Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Hydroxybenzoic acid derivatives
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Level 6
Salicylic acid and derivatives
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Level 7
Acylsalicylic acids and derivatives
- Level 8 Acylsalicylamides
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Level 7
Acylsalicylic acids and derivatives
-
Level 6
Salicylic acid and derivatives
-
Level 5
Hydroxybenzoic acid derivatives
-
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
Hydroxybenzoic acid derivatives - Salicylic acid and derivatives - Acylsalicylic acids and derivatives
Direct Parent
Acylsalicylamides
Alternative Parents
Phenol esters Benzamides Thiazolecarboxylic acids and derivatives Phenoxy compounds 2,4,5-trisubstituted thiazoles Benzoyl derivatives Fatty acid esters Dicarboxylic acids and derivatives Sulfones Methyl esters Heteroaromatic compounds Secondary carboxylic acid amides Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Acylsalicylamide - Phenol ester - Benzamide - 2,4,5-trisubstituted 1,3-thiazole - Phenoxy compound - Benzoyl - Thiazolecarboxylic acid or derivatives - Fatty acid ester - Dicarboxylic acid or derivatives - Fatty acyl - Azole - Heteroaromatic compound - Methyl ester - Thiazole - Sulfonyl - Sulfone - Carboxamide group - Carboxylic acid ester - Secondary carboxylic acid amide - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylsalicylamides. These are o-acylated derivatives of salicylamide.
External Descriptors
Not available