Compound Identification
SMILES
OCC(NC(=O)C1=CC=CC=C1NC1=CC=CC(=C1)C(F)(F)F)C(=O)N1CCCCCC1
InChIKey
InChIKey=FAHXBUKQRNQMEU-UHFFFAOYSA-N
Formula
C23H26F3N3O3
Mass
449.474
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 Alpha amino acid amides Trifluoromethylbenzenes 2-aminobenzamides Anthranilamides Aniline and substituted anilines Benzoyl derivatives Azepanes Primary aromatic amines Vinylogous amides Tertiary carboxylic acid amides Secondary carboxylic acid amides Secondary amines Azacyclic compounds Alkyl fluorides Organic oxides Organofluorides Primary alcohols Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Anthranilamide - Alpha-amino acid or derivatives - Trifluoromethylbenzene - Aminobenzamide - 2-aminobenzamide - Aminobenzoic acid or derivatives - Aniline or substituted anilines - Benzoyl - Azepane - Primary aromatic amine - Vinylogous amide - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Secondary amine - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Alcohol - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - 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