Compound Identification
SMILES
BrC1CC2C(CC1Br)C(=O)N(C2=O)C1=CC=CC(=C1)C(=O)OCC(=O)C1=CC=CC=C1
InChIKey
InChIKey=XYRKRNPCLCCLMP-UHFFFAOYSA-N
Formula
C23H19Br2NO5
Mass
549.215
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
Alkyl-phenylketones Phenylpyrrolidines Benzoic acid esters Isoindolones Isoindoles Benzoyl derivatives Aryl alkyl ketones N-substituted carboxylic acid imides Pyrrolidine-2-ones Dicarboximides Pyrroles Lactams Carboxylic acid esters Azacyclic compounds Organic oxides Organonitrogen compounds Alkyl bromides Hydrocarbon derivatives Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - Alkyl-phenylketone - 1-phenylpyrrolidine - Benzoate ester - Isoindolone - Isoindoline - Phenylketone - Isoindole - Isoindole or derivatives - Benzoyl - Aryl alkyl ketone - Aryl ketone - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Dicarboximide - Pyrrolidine - Pyrrole - Carboxylic acid ester - Lactam - Ketone - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alkyl halide - Alkyl bromide - Organohalogen compound - Carbonyl group - Organic oxygen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic 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