Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(=CC(NS(=O)(=O)C2=CC(N3C(=O)C4=C(C=C(C=C4)C(O)=O)C3=O)=C(Cl)C=C2)=C1)C(=O)OC

InChIKey

InChIKey=NEGVXHYEEPOTQO-UHFFFAOYSA-N

Formula

C25H17ClN2O10S

Mass

572.93

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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

Phthalic acid and derivatives - Phthalate esters

Direct Parent

m-Phthalate esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Meta-phthalic acid ester - Meta_phthalic_acid - Phthalimide - Isoindolone - Benzenesulfonamide - Benzoate ester - Sulfanilide - Isoindole or derivatives - Benzenesulfonyl group - Isoindole - Isoindoline - Benzoyl - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Carboxylic acid imide, n-substituted - Organosulfonic acid amide - Organic sulfonic acid or derivatives - Sulfonyl - Carboxylic acid imide - Aminosulfonyl compound - Methyl ester - Organosulfonic acid or derivatives - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Carboxylic acid - Organic oxide - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as m-phthalate esters. These are ester derivatives of m-phthalic acids, which are based on a benzene 1,3-dicarboxylic acid skeleton.

External Descriptors

Not available

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