Compound Identification
SMILES
CCOC(=O)C1=C(CSC2=CC=CC=C2)N(C)C2=CC(Br)=C(OCC(O)CN(CCO)CCO)C=C12
InChIKey
InChIKey=HVTBCMWYDUIPNY-UHFFFAOYSA-N
Formula
C26H33BrN2O6S
Mass
581.52
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
N-alkylindoles Indoles Thiophenol ethers Phenol ethers Pyrrole carboxylic acids and derivatives Alkylarylthioethers Alkyl aryl ethers Benzene and substituted derivatives N-methylpyrroles Aryl bromides Vinylogous amides Heteroaromatic compounds 1,2-aminoalcohols Amino acids and derivatives Trialkylamines Carboxylic acid esters Secondary alcohols Sulfenyl compounds Azacyclic compounds Organic oxides Organobromides Hydrocarbon derivatives Primary alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - N-alkylindole - Indole - Aryl thioether - Phenol ether - Pyrrole-3-carboxylic acid or derivatives - Thiophenol ether - Alkyl aryl ether - Alkylarylthioether - N-methylpyrrole - Aryl bromide - Substituted pyrrole - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Pyrrole - Vinylogous amide - Tertiary amine - Amino acid or derivatives - Secondary alcohol - Carboxylic acid ester - Tertiary aliphatic amine - 1,2-aminoalcohol - Alkanolamine - Azacycle - Sulfenyl compound - Carboxylic acid derivative - Thioether - Ether - Organic oxide - Amine - Organic oxygen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Primary alcohol - Organosulfur compound - Organooxygen compound - Organohalogen compound - Organobromide - Organonitrogen 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