Compound Identification
SMILES
OC(=O)C1=CC=C(NC(=O)C(\NC(=O)C2=CC(Br)=CC=C2)=C\C2=CC(=CC=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=WPBKNKDECLPIOZ-NDENLUEZSA-N
Formula
C23H16BrN3O6
Mass
510.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Acylaminobenzoic acid and derivatives
Alternative Parents
Hippuric acids and derivatives N-acyl-alpha amino acids and derivatives Cinnamic acid amides Alpha amino acid amides 3-halobenzoic acids and derivatives Benzoic acids Anilides Nitrobenzenes Nitroaromatic compounds N-arylamides Benzoyl derivatives Bromobenzenes Aryl bromides Secondary carboxylic acid amides Propargyl-type 1,3-dipolar organic compounds Carboxylic acids Organic oxoazanium compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organobromides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - N-acyl-alpha amino acid or derivatives - Hippuric acid or derivatives - Alpha-amino acid amide - Cinnamic acid or derivatives - Cinnamic acid amide - Alpha-amino acid or derivatives - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Nitrobenzene - Anilide - Benzamide - Benzoic acid - Nitroaromatic compound - Benzoyl - N-arylamide - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - C-nitro compound - Organic nitro compound - Carboxamide group - Secondary carboxylic acid amide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Carboxylic acid - Organic oxoazanium - Organic oxide - Organic zwitterion - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organobromide - Organic salt - Organohalogen compound - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as acylaminobenzoic acid and derivatives. These are derivatives of amino benzoic acid derivatives where the amine group is N-acylated.
External Descriptors
Not available