Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(C)N1C(=O)C(C)(SC)C2=C1C=CC(OC1=C(Cl)C=C(C=C1)C(F)(F)F)=C2

InChIKey

InChIKey=QOFKJOLAWODQID-UHFFFAOYSA-N

Formula

C22H21ClF3NO4S

Mass

487.92

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Carboxylic acids and derivatives

Subclass

Amino acids, peptides, and analogues

Intermediate Tree Nodes

Amino acids and derivatives - Alpha amino acids and derivatives

Direct Parent

Alpha amino acid esters

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alpha-amino acid ester - Indolyl carboxylic acid derivative - Alanine or derivatives - Diaryl ether - Trifluoromethylbenzene - Indole or derivatives - Indole - Phenoxy compound - Phenol ether - Chlorobenzene - Halobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Tertiary carboxylic acid amide - Lactam - Carboxylic acid ester - Carboxamide group - Azacycle - Organoheterocyclic compound - Dialkylthioether - Sulfenyl compound - Ether - Thioether - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Hydrocarbon derivative - Organohalogen compound - Organochloride - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alpha amino acid esters. These are ester derivatives of alpha amino acids.

External Descriptors

Not available

Previous Back Next