Structure Information
Structure

Compound Identification

SMILES

COCCN(CC1=CC(OS(=O)(=O)C2=CC=C(F)C=C2)=C(OC)C=C1)C(=O)NC1=C(C=CC=C1C(C)C)C(C)C

InChIKey

InChIKey=LZJKMAMDLGACEL-UHFFFAOYSA-N

Formula

C30H37FN2O6S

Mass

572.69

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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

Benzenesulfonate esters

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Benzenesulfonate ester - N-phenylurea - Cumene - Arylsulfonic acid or derivatives - Phenylpropane - Benzenesulfonyl group - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Fluorobenzene - Halobenzene - Alkyl aryl ether - Organosulfonic acid ester - Aryl fluoride - Aryl halide - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Urea - Dialkyl ether - Ether - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organohalogen compound - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzenesulfonate esters. These are arenesulfonate esters that result from the formal condensation of the hydroxy group of an alcohol, enol, phenol or heteroarenol with benzenesulfonic acid.

External Descriptors

Not available

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