Compound Identification
SMILES
COC(=O)C1=CC(OC(C(=O)NS(=O)(=O)C2=CC=CC=C2)C2=CC3=NSN=C3C=C2)=CC=C1
InChIKey
InChIKey=JCMQCRACVKPZNZ-UHFFFAOYSA-N
Formula
C22H17N3O6S2
Mass
483.51
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
Benzenesulfonamides Benzenesulfonyl compounds Benzothiadiazoles Phenoxy compounds Phenol ethers Benzoyl derivatives Alkyl aryl ethers Thiadiazoles Aminosulfonyl compounds Organosulfonic acids and derivatives Methyl esters Heteroaromatic compounds Azacyclic compounds Organic oxides Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoate ester - Benzenesulfonamide - 2,1,3-benzothiadiazole - Benzenesulfonyl group - Phenol ether - Benzoyl - Phenoxy compound - Alkyl aryl ether - Methyl ester - Aminosulfonyl compound - Thiadiazole - Sulfonyl - Organosulfonic acid or derivatives - Heteroaromatic compound - Organic sulfonic acid or derivatives - Azole - Carboxylic acid ester - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organosulfur compound - Organic oxide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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