Compound Identification
SMILES
CCOC1=C(OCC#C)C(Cl)=CC(C=NNC(=O)C(NC(=O)C2=CC(Cl)=C(Cl)C=C2)C(C)C)=C1
InChIKey
InChIKey=JHXXOIKSTHMHDR-UHFFFAOYSA-N
Formula
C24H24Cl3N3O4
Mass
524.82
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Benzoic acids and derivatives
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Level 5
Benzamides
- Level 6 Hippuric acids and derivatives
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Level 5
Benzamides
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Subclass
Benzoic acids and derivatives
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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
Valine and derivatives N-acyl-alpha amino acids and derivatives 4-halobenzoic acids and derivatives 3-halobenzoic acids and derivatives Phenoxy compounds Phenol ethers Benzoyl derivatives Chlorobenzenes Alkyl aryl ethers N-acyl amines Vinyl chlorides Haloacetylenes and derivatives Chloroalkenes Carboxylic acid amides Acetylides Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Valine or derivatives - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Alpha-amino acid or derivatives - N-substituted-alpha-amino acid - Phenoxy compound - Phenol ether - Benzoyl - Halobenzene - Chlorobenzene - Alkyl aryl ether - N-acyl-amine - Carboxamide group - Haloacetylene or derivatives - Acetylide - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - Ether - Carboxylic acid derivative - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - 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