Compound Identification
SMILES
[O-]C(=O)C1=C(CCNC(=O)C2=CC=CC=C2C([O-])=O)C2=C(N1)C=CC(Br)=C2
InChIKey
InChIKey=JPNLHIGDDCGNSU-UHFFFAOYSA-L
Formula
C19H13BrN2O5
Mass
429.227
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Indolecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolecarboxylic acids and derivatives
Alternative Parents
3-alkylindoles Benzamides Benzoic acids Pyrrole 2-carboxylic acids Benzoyl derivatives Substituted pyrroles Aryl bromides Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid salts Azacyclic compounds Carboxylic acids Organooxygen compounds Hydrocarbon derivatives Organic oxides Organobromides Organonitrogen compounds Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - 3-alkylindole - Benzamide - Benzoic acid or derivatives - Indole - Benzoic acid - Pyrrole-2-carboxylic acid or derivatives - Pyrrole-2-carboxylic acid - Benzoyl - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Carboxylic acid salt - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic anion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids and derivatives. These are compounds containing a carboxylic acid group (or a derivative thereof) linked to an indole.
External Descriptors
Not available