Compound Identification
SMILES
COC1=CC=C(NCCNC(=O)C(CC2CCCCC2)NC(=O)C2=C(Cl)C(C)=CC=C2)C=C1
InChIKey
InChIKey=XUTRLGFVOJNBST-UHFFFAOYSA-N
Formula
C26H34ClN3O3
Mass
472.03
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 2-halobenzoic acids and derivatives m-Toluamides Aminophenyl ethers Methoxyanilines Anisoles Benzoyl derivatives Phenylalkylamines Methoxybenzenes Phenoxy compounds Chlorobenzenes Alkyl aryl ethers Secondary alkylarylamines Fatty amides Aryl chlorides Vinylogous halides Secondary carboxylic acid amides Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides
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 - Alpha-amino acid or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Aminophenyl ether - M-toluamide - Toluamide - Methoxyaniline - Benzoyl - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Chlorobenzene - Alkyl aryl ether - Toluene - Halobenzene - Aryl chloride - Aryl halide - Fatty amide - Fatty acyl - Vinylogous halide - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - Secondary amine - Carboxylic acid derivative - Ether - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen 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