Compound Identification
SMILES
FC(F)(F)C1(NC(=O)C2=CC=CO2)C(=O)NC2=C1C(=O)NC(=O)N2C1=CC=C(Cl)C=C1
InChIKey
InChIKey=CXHCHCMYVUBLIC-UHFFFAOYSA-N
Formula
C18H10ClF3N4O5
Mass
454.75
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Carboxylic acids and derivatives
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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 2-heteroaryl carboxamides Furoic acid and derivatives Chlorobenzenes Pyrimidones Aryl chlorides Pyrroles Vinylogous amides Heteroaromatic compounds Secondary carboxylic acid amides Ureas Lactams Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Carbonyl compounds Organofluorides Organonitrogen compounds Organopnictogen compounds Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Pyrrolopyrimidine - 2-heteroaryl carboxamide - Furoic acid or derivatives - Chlorobenzene - Halobenzene - Pyrimidone - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Benzenoid - Furan - Heteroaromatic compound - Pyrrole - Vinylogous amide - Urea - Secondary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Oxacycle - Organoheterocyclic compound - Organic nitrogen compound - Organohalogen compound - Alkyl halide - Organochloride - Hydrocarbon derivative - Alkyl fluoride - Organic oxide - Organofluoride - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organonitrogen 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