Compound Identification
SMILES
COC(=O)C(CC1=N\C(=N/NC2=CC=C(Br)C=C2)N=C1N=NC1=CC=C(Br)C=C1)NC(=O)C1=CC=CC=C1
InChIKey
InChIKey=OGLDMUHUSPJRKD-ABKWKXMISA-N
Formula
C26H21Br2N7O3
Mass
639.308
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
Alpha amino acid esters N-acyl-alpha amino acids and derivatives Benzoyl derivatives Imidazolyl carboxylic acids and derivatives Phenylhydrazines Fatty acid esters Bromobenzenes Aryl bromides Methyl esters Secondary carboxylic acid amides Azo compounds Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Hydrazones Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organobromides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Alpha-amino acid ester - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid or derivatives - Imidazolyl carboxylic acid derivative - Benzoyl - Phenylhydrazine - Bromobenzene - Halobenzene - Fatty acid ester - Aryl bromide - Aryl halide - Fatty acyl - Methyl ester - Carboxylic acid ester - Secondary carboxylic acid amide - Carboxamide group - Azo compound - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Hydrazone - Monocarboxylic acid or derivatives - Organic oxide - Carbonyl group - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic nitrogen compound - Organic oxygen compound - Aromatic heteromonocyclic 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