Structure Information
Structure

Compound Identification

SMILES

CC1=CC=C(C=C1)S(=O)(=O)O[I](C#CC1=CC=CC=C1)C1=CC=CC=C1

InChIKey

InChIKey=DWIJRFFJRQAGSK-UHFFFAOYSA-N

Formula

C21H17IO3S

Mass

476.33

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzenesulfonic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

p-Methylbenzenesulfonates

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

P-methylbenzenesulfonate - Tosyl compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Halobenzene - Toluene - Iodobenzene - Aryl halide - Aryl iodide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Haloacetylene or derivatives - Organoiodide - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organic oxygen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as p-methylbenzenesulfonates. These are benzenesulfonic acids (or derivative thereof) carrying a methyl group at the para- position.

External Descriptors

Not available

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