Structure Information
Structure

Compound Identification

SMILES

OC(=O)COC1=C(CN2CCCN(CC2)S(=O)(=O)C2=CC=C(F)C=C2)C=C(C=C1)C(F)(F)F

InChIKey

InChIKey=NICXRKSDXYULRK-UHFFFAOYSA-N

Formula

C21H22F4N2O5S

Mass

490.47

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Phenoxyacetic acid derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Phenoxyacetic acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Phenoxyacetate - Trifluoromethylbenzene - Benzenesulfonamide - Benzenesulfonyl group - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - 1,4-diazepane - Alkyl aryl ether - Diazepane - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Organosulfonic acid amide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Amino acid or derivatives - Amino acid - Ether - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic oxide - Amine - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenoxyacetic acid derivatives. These are compounds containing an anisole where the methane group is linked to an acetic acid or a derivative.

External Descriptors

Not available

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