Compound Identification
SMILES
FC(F)(F)C1=CC=CC(=C1)C(=O)NCC(=O)N[C@H]1CCCC[C@@H]1NCC1=CC=C(Cl)C=C1
InChIKey
InChIKey=PXLJHQVPKCBLFJ-PMACEKPBSA-N
Formula
C23H25ClF3N3O2
Mass
467.92
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 Phenylmethylamines Benzoyl derivatives Benzylamines Aralkylamines Cyclohexylamines Chlorobenzenes Aryl chlorides Secondary carboxylic acid amides Dialkylamines Alkyl fluorides Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Carbonyl compounds
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - Alpha-amino acid amide - N-substituted-alpha-amino acid - Trifluoromethylbenzene - Alpha-amino acid or derivatives - Benzylamine - Benzoyl - Phenylmethylamine - Cyclohexylamine - Halobenzene - Aralkylamine - Chlorobenzene - Aryl chloride - Aryl halide - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Secondary amine - Carboxylic acid derivative - Secondary aliphatic amine - Organochloride - Carbonyl group - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Alkyl halide - Organohalogen compound - Organic nitrogen 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