Compound Identification
SMILES
CCOC(=O)C1=C(CBr)N(C2=C1C=C(OC)C=C2)S(=O)(=O)C1=CC=CC=C1
InChIKey
InChIKey=PEHRVRCDONMFAX-UHFFFAOYSA-N
Formula
C19H18BrNO5S
Mass
452.32
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
Benzenesulfonamides Benzenesulfonyl compounds Indoles Pyrrole carboxylic acids and derivatives Anisoles Alkyl aryl ethers Substituted pyrroles Organosulfonic acids and derivatives Heteroaromatic compounds Vinylogous amides Sulfonyls Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Alkyl bromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - Benzenesulfonamide - Indole - Benzenesulfonyl group - Anisole - Phenol ether - Pyrrole-3-carboxylic acid or derivatives - Alkyl aryl ether - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Organic sulfonic acid or derivatives - Heteroaromatic compound - Pyrrole - Organosulfonic acid or derivatives - Sulfonyl - Vinylogous amide - Carboxylic acid ester - Azacycle - Ether - Carboxylic acid derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Alkyl halide - Alkyl bromide - 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