Compound Identification
SMILES
CCOC(=O)C1=C(COC2=CC=CC=C2)N(C)C2=CC(Br)=C(O)C(CN3CCCCC3)=C12
InChIKey
InChIKey=MJJYSRHUVWPUFR-UHFFFAOYSA-N
Formula
C25H29BrN2O4
Mass
501.421
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
Hydroxyindoles N-alkylindoles Indoles Pyrrole carboxylic acids and derivatives O-bromophenols Phenol ethers Phenoxy compounds Alkyl aryl ethers Aralkylamines N-methylpyrroles Aryl bromides Piperidines Vinylogous amides Heteroaromatic compounds Amino acids and derivatives Trialkylamines Carboxylic acid esters Azacyclic compounds Organic oxides Hydrocarbon derivatives Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - N-alkylindole - Hydroxyindole - Indole - Pyrrole-3-carboxylic acid or derivatives - Phenoxy compound - Phenol ether - 2-bromophenol - 2-halophenol - Phenol - Alkyl aryl ether - Aralkylamine - N-methylpyrrole - Aryl halide - Substituted pyrrole - Aryl bromide - Benzenoid - Monocyclic benzene moiety - Piperidine - Heteroaromatic compound - Vinylogous amide - Pyrrole - Amino acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Ether - Organobromide - Organic nitrogen compound - Amine - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - 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