Structure Information
Structure

Compound Identification

SMILES

CC1=CC(C(=O)COC(=O)C2=C(O)C(C)=CC=C2)=C(C)N1[C@@H]1CCS(=O)(=O)C1

InChIKey

InChIKey=BMVLCGPHUPBDBX-OAHLLOKOSA-N

Formula

C20H23NO6S

Mass

405.47

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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 - Benzoyl - O-cresol - Aryl ketone - Aryl alkyl ketone - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Toluene - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Vinylogous amide - Sulfone - Thiolane - Vinylogous acid - Carboxylic acid ester - Ketone - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen 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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