Compound Identification
SMILES
FC1=CC=C(C=C1)N1C2=C(C(=O)NC1=O)C(NC(=O)C1=CN=CC=C1)(C(=O)N2)C(F)(F)F
InChIKey
InChIKey=VLVQBCPQUOXMNL-UHFFFAOYSA-N
Formula
C19H11F4N5O4
Mass
449.322
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
Nicotinamides Pyrrolopyrimidines Fluorobenzenes Pyrimidones Aryl fluorides Vinylogous amides Heteroaromatic compounds Pyrroles Secondary carboxylic acid amides Lactams Ureas Azacyclic compounds Organic oxides Hydrocarbon derivatives Alkyl fluorides Carbonyl compounds Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-alpha amino acid or derivatives - Nicotinamide - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Pyrrolopyrimidine - Fluorobenzene - Halobenzene - Pyrimidone - Benzenoid - Pyrimidine - Pyridine - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Pyrrole - Vinylogous amide - Urea - Secondary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organohalogen compound - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - 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