Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC(=CC(NS(=O)(=O)C2=CC=C(I)C=C2)=C1)C(=O)OC

InChIKey

InChIKey=XPZAQLQVLBOFSS-UHFFFAOYSA-N

Formula

C16H14INO6S

Mass

475.25

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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 homomonocyclic compounds

Substituents

Meta-phthalic acid ester - Meta_phthalic_acid - Sulfanilide - Benzenesulfonamide - Benzoate ester - Benzenesulfonyl group - Benzoyl - Halobenzene - Iodobenzene - Aryl halide - Organosulfonic acid amide - Aryl iodide - Dicarboxylic acid or derivatives - Methyl ester - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Organoiodide - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organohalogen compound - Aromatic homomonocyclic 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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