Compound Identification
SMILES
CC1=CC(C(=O)N2CCC3=C(C2)C2=CC=CC=C2N3CC(O)=O)=C(Br)C=C1
InChIKey
InChIKey=FDJGWTLACLBPAZ-UHFFFAOYSA-N
Formula
C21H19BrN2O3
Mass
427.298
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
Indolyl carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolyl carboxylic acids and derivatives
Alternative Parents
N,N-dialkyl-m-toluamides 2-halobenzoic acids and derivatives 3-alkylindoles Alpha amino acids and derivatives N-alkylindoles Benzamides Benzoyl derivatives Bromobenzenes Substituted pyrroles Aryl bromides Vinylogous halides Tertiary carboxylic acid amides Heteroaromatic compounds Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Organic oxides Organobromides Carbonyl compounds Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolyl carboxylic acid derivative - N,n-dialkyl-m-toluamide - Alpha-amino acid or derivatives - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 3-alkylindole - N-alkylindole - Benzamide - M-toluamide - Indole - Toluamide - Benzoic acid or derivatives - Benzoyl - Halobenzene - Toluene - Bromobenzene - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Benzenoid - Substituted pyrrole - Heteroaromatic compound - Pyrrole - Tertiary carboxylic acid amide - Vinylogous halide - Carboxamide group - Azacycle - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolyl carboxylic acids and derivatives. These are compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an indole ring.
External Descriptors
Not available