Compound Identification
SMILES
CCC[C@H](O)[C@H](CNC(C)CC)NC(=O)CNC(=O)C1=CC(=CC=C1)C(F)(F)F
InChIKey
InChIKey=CAUUVDPEERCXKF-LMARGRMVSA-N
Formula
C20H30F3N3O3
Mass
417.473
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 Benzoyl derivatives 1,3-aminoalcohols Secondary carboxylic acid amides Secondary alcohols Dialkylamines Organofluorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl fluorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - Trifluoromethylbenzene - N-substituted-alpha-amino acid - Alpha-amino acid or derivatives - Benzoyl - 1,3-aminoalcohol - Secondary carboxylic acid amide - Amino acid or derivatives - Secondary alcohol - Carboxamide group - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Alcohol - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl fluoride - Organofluoride - Organohalogen compound - Aromatic homomonocyclic 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