Structure Information
Structure

Compound Identification

SMILES

N[C@@H](CC(N)=O)C1=NC(CC2=CC=C(C=C2)C(F)(F)F)=NO1

InChIKey

InChIKey=PVYKWSNQRCFEIG-VIFPVBQESA-N

Formula

C13H13F3N4O2

Mass

314.268

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

Direct Parent

Beta amino acids and derivatives

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Beta amino acid or derivatives - Trifluoromethylbenzene - Aralkylamine - Monocyclic benzene moiety - Fatty amide - Benzenoid - Fatty acyl - Heteroaromatic compound - Azole - 1,2,4-oxadiazole - Oxadiazole - Carboxamide group - Primary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Oxacycle - Alkyl halide - Organonitrogen compound - Organofluoride - Organohalogen compound - Primary aliphatic amine - Alkyl fluoride - Organic oxide - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Amine - Organooxygen compound - Primary amine - Hydrocarbon derivative - Aromatic heteromonocyclic 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

Previous Back Next