Compound Identification
SMILES
CC1CC(C)CN(C1)C(=O)CC1=C(NC2=C1C=C(Cl)C=C2)C([O-])=O
InChIKey
InChIKey=QYPHOIYMMDYWFE-UHFFFAOYSA-M
Formula
C18H20ClN2O3
Mass
347.82
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 N-acylpiperidines Pyrrole 2-carboxylic acids Substituted pyrroles Aryl chlorides Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Carboxylic acid salts Azacyclic compounds Carboxylic acids Organonitrogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organic anions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - 3-alkylindole - Indole - N-acyl-piperidine - Pyrrole-2-carboxylic acid or derivatives - Pyrrole-2-carboxylic acid - Aryl chloride - Aryl halide - Benzenoid - Substituted pyrrole - Piperidine - Heteroaromatic compound - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Carboxylic acid salt - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organohalogen compound - Organochloride - Organonitrogen compound - 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