Compound Identification
SMILES
FC(F)(F)C1(NC(=O)CCC2=CC=CC=C2)C(=O)NC2=C1C(=O)NC(=O)N2C1=CC=C(Cl)C=C1
InChIKey
InChIKey=GTNNRHCEGWCARS-UHFFFAOYSA-N
Formula
C22H16ClF3N4O4
Mass
492.84
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
-
Subclass
Amino acids, peptides, and analogues
- Level 5 Amino acids and derivatives
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Subclass
Amino acids, peptides, and analogues
-
Class
Carboxylic acids and derivatives
-
Superclass
Organic acids and derivatives
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
N-acyl-alpha amino acids and derivatives
Alternative Parents
Pyrrolopyrimidines Chlorobenzenes Pyrimidones Aryl chlorides Fatty amides Vinylogous amides Pyrroles Heteroaromatic compounds Lactams Secondary carboxylic acid amides Ureas Azacyclic compounds Organonitrogen compounds Organofluorides Organochlorides Organic oxides Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Pyrrolopyrimidine - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Pyrimidine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Pyrrole - Secondary carboxylic acid amide - Urea - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Alkyl halide - Organohalogen compound - Organochloride - Organofluoride - Alkyl fluoride - Hydrocarbon derivative - Organonitrogen compound - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as n-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid (or a derivative thereof) which bears an acyl group at its terminal nitrogen atom.
External Descriptors
Not available