Compound Identification
SMILES
COC(=O)C1=CC(=CC=C1)N1C(=O)C2C3CC(C(Br)C3Br)C2C1=O
InChIKey
InChIKey=ISHCKAGUDSDJBO-UHFFFAOYSA-N
Formula
C17H15Br2NO4
Mass
457.118
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
Phenylpyrrolidines Aromatic monoterpenoids Benzoic acid esters Isoindolones Benzoyl derivatives Pyrrolidine-2-ones N-substituted carboxylic acid imides Pyrroles Methyl esters Dicarboximides Lactams Azacyclic compounds Alkyl bromides Carbonyl compounds Organic oxides Organobromides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Acylaminobenzoic acid or derivatives - 1-phenylpyrrolidine - Aromatic monoterpenoid - Benzoate ester - Norbornane monoterpenoid - Monoterpenoid - Isoindolone - Isoindoline - Isoindole or derivatives - Benzoyl - Carboxylic acid imide, n-substituted - 2-pyrrolidone - Pyrrolidone - Pyrrole - Pyrrolidine - Methyl ester - Dicarboximide - Carboxylic acid imide - Carboxylic acid ester - Lactam - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Alkyl halide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Alkyl bromide - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organobromide - Organohalogen 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