Structure Information
Structure

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

Export to:

JSON SDF CSV

Taxonomic Classification

Taxonomy Tree

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

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

Previous Back Next