Structure Information
Structure

Compound Identification

SMILES

CC(O)=O.FC1=CC(F)=C2NC(=O)C3(CCCNC3)C2=C1

InChIKey

InChIKey=DWFZHAOBSBNWKN-UHFFFAOYSA-N

Formula

C14H16F2N2O3

Mass

298.29

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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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Not available

Substituents

Beta amino acid or derivatives - Indole or derivatives - Dihydroindole - Aralkylamine - Aryl fluoride - Aryl halide - Benzenoid - Piperidine - Carboxamide group - Secondary carboxylic acid amide - Lactam - Carboxylic acid - Secondary aliphatic amine - Azacycle - Organoheterocyclic compound - Secondary amine - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom.

External Descriptors

Not available

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