Compound Identification
SMILES
COC(=O)C(NC(=O)C1=CC=CC=C1)=CNC1=CN=C(OC2=C(F)C=C(F)C=C2)C=C1
InChIKey
InChIKey=VOUOELWBNOADCM-UHFFFAOYSA-N
Formula
C22H17F2N3O4
Mass
425.392
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Benzoic acids and derivatives
-
Level 5
Benzamides
- Level 6 Hippuric acids and derivatives
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Level 5
Benzamides
-
Subclass
Benzoic acids and derivatives
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Benzamides
Direct Parent
Hippuric acids and derivatives
Alternative Parents
N-acyl-alpha amino acids and derivatives Diarylethers Phenoxy compounds Phenol ethers Benzoyl derivatives Aminopyridines and derivatives Fluorobenzenes Aryl fluorides Vinylogous amides Methyl esters Heteroaromatic compounds Enoate esters Secondary carboxylic acid amides Monocarboxylic acids and derivatives Azacyclic compounds Enamines Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Diaryl ether - Alpha-amino acid or derivatives - Phenoxy compound - Benzoyl - Phenol ether - Aminopyridine - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Pyridine - Heteroaromatic compound - Vinylogous amide - Alpha,beta-unsaturated carboxylic ester - Methyl ester - Enoate ester - Carboxylic acid ester - Carboxamide group - Secondary carboxylic acid amide - Azacycle - Organoheterocyclic compound - Carboxylic acid derivative - Enamine - Ether - Monocarboxylic acid or derivatives - Organooxygen compound - Organic oxygen compound - Amine - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as hippuric acids and derivatives. These are compounds containing a hippuric acid or a derivative, with a structure characterized the presence of a benzoyl group linked to the N-terminal of a glycine.
External Descriptors
Not available