Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(O)C=C(C=C1)S(=O)(=O)N1CC(=O)CCC(CC2=C(OC)C=CC(Cl)=C2)C1=O

InChIKey

InChIKey=ORKTYICZOJPIMX-UHFFFAOYSA-N

Formula

C22H22ClNO8S

Mass

495.93

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzoic acids and derivatives

Intermediate Tree Nodes

Benzoic acid esters

Direct Parent

o-Hydroxybenzoic acid esters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

O-hydroxybenzoic acid ester - Salicylic acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Phenol ether - Benzoyl - Anisole - Caprolactam - Methoxybenzene - Azepane - Chlorobenzene - Halobenzene - 1-hydroxy-2-unsubstituted benzenoid - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Alkyl aryl ether - Aryl chloride - Aryl halide - Sulfonyl - Methyl ester - Vinylogous acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Cyclic ketone - Carboxylic acid ester - Lactam - Ketone - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Carbonyl group - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organic oxide - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-hydroxybenzoic acid esters. These are benzoic acid esters where the benzene ring is ortho-substituted with a hydroxy group.

External Descriptors

Not available

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