Compound Identification
SMILES
CC(C)C(=O)NC1=CC2=C(C=C1)C(=CN2)[C@H]([NH+]1CCN(CC1)C1=CC=C(Cl)C=C1)C([O-])=O
InChIKey
InChIKey=KZYZLSOLCQZQOK-QFIPXVFZSA-N
Formula
C24H27ClN4O3
Mass
454.96
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Indoles and derivatives
-
Subclass
Indolyl carboxylic acids and derivatives
- Level 5 Indole-3-acetic acid derivatives
-
Subclass
Indolyl carboxylic acids and derivatives
-
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
Indole-3-acetic acid derivatives
Alternative Parents
N-arylpiperazines Phenylpiperazines L-alpha-amino acids 3-alkylindoles Dialkylarylamines N-arylamides Aniline and substituted anilines Aralkylamines N-alkylpiperazines Chlorobenzenes Substituted pyrroles Aryl chlorides Heteroaromatic compounds Quaternary ammonium salts Carboxylic acid salts Trialkylamines Amino acids Secondary carboxylic acid amides Carboxylic acids Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole-3-acetic acid derivative - Phenylpiperazine - N-arylpiperazine - Alpha-amino acid - Alpha-amino acid or derivatives - L-alpha-amino acid - 3-alkylindole - Indole - Aniline or substituted anilines - Dialkylarylamine - N-arylamide - Chlorobenzene - Halobenzene - Aralkylamine - N-alkylpiperazine - Aryl chloride - Aryl halide - Monocyclic benzene moiety - 1,4-diazinane - Piperazine - Substituted pyrrole - Benzenoid - Quaternary ammonium salt - Pyrrole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Carboxylic acid salt - Amino acid - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Carboxylic acid - Organic zwitterion - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - Carbonyl group - Amine - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic salt - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indole-3-acetic acid derivatives. These are compounds containing an acetic acid (or a derivative) linked to the C3 carbon atom of an indole.
External Descriptors
Not available