Structure Information
Structure

Compound Identification

SMILES

COC(C(=O)O[C@@H](CCC#N)CC1=CC=CC=C1)(C1=CC=CC=C1)C(F)(F)F

InChIKey

InChIKey=LCHACDMZUSPFII-LROBGIAVSA-N

Formula

C21H20F3NO3

Mass

391.39

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Benzylethers

Intermediate Tree Nodes

Not available

Direct Parent

Benzylethers

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Benzylether - Carboxylic acid ester - Carboxylic acid derivative - Dialkyl ether - Ether - Monocarboxylic acid or derivatives - Carbonitrile - Nitrile - Organohalogen compound - Alkyl fluoride - Carbonyl group - Organic nitrogen compound - Alkyl halide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Cyanide - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzylethers. These are aromatic ethers with the general formula ROCR' (R = alkyl, aryl; R'=benzene).

External Descriptors

Not available

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