Compound Identification
SMILES
CC(=O)OC1=CC=C(C=C1)C(=O)COC(=O)CNC(=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=WGEBSEYSRNEHQL-UHFFFAOYSA-N
Formula
C19H16ClNO6
Mass
389.79
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
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
-
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 esters Alkyl-phenylketones Phenol esters 4-halobenzoic acids and derivatives Phenoxy compounds Benzoyl derivatives Aryl alkyl ketones Chlorobenzenes Alpha-acyloxy ketones N-acyl amines Dicarboxylic acids and derivatives Alpha-branched alpha,beta-unsaturated ketones Enones Enol esters Acryloyl compounds Vinyl chlorides Chloroalkenes Carboxylic acid amides Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Alkyl-phenylketone - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid ester - Halobenzoic acid or derivatives - 4-halobenzoic acid or derivatives - Phenol ester - Alpha-amino acid or derivatives - Phenylketone - Phenoxy compound - Aryl alkyl ketone - Aryl ketone - Benzoyl - Alpha-acyloxy ketone - Halobenzene - Chlorobenzene - Alpha-branched alpha,beta-unsaturated-ketone - N-acyl-amine - Dicarboxylic acid or derivatives - Alpha,beta-unsaturated ketone - Enone - Enol ester - Acryloyl-group - Ketone - Carboxylic acid ester - Carboxamide group - Chloroalkene - Haloalkene - Vinyl halide - Vinyl chloride - 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