Structure Information
Structure

Compound Identification

SMILES

CC(=O)NCCC1=C(CC2=CC=CC=C2)OC2=C1C=C(OS(=O)(=O)C(F)(F)F)C=C2

InChIKey

InChIKey=LDEXHJNEQORDCB-UHFFFAOYSA-N

Formula

C20H18F3NO5S

Mass

441.42

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Carboxylic acid derivatives

Intermediate Tree Nodes

Carboxylic acid amides - Acetamides

Direct Parent

N-acetyl-2-arylethylamines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

N-acetyl-2-arylethylamine - Benzofuran - Trifluoromethanesulfonate - Monocyclic benzene moiety - Sulfonic acid ester - Organosulfonic acid ester - Benzenoid - Furan - Methanesulfonate - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Heteroaromatic compound - Trihalomethane - Secondary carboxylic acid amide - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Organic oxygen compound - Halomethane - Organic oxide - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as n-acetyl-2-arylethylamines. These are compounds containing an acetamide group that is N-linked to an arylethylamine.

External Descriptors

Not available

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