Compound Identification
SMILES
OC(=O)CC1N(CC2=CC=C(Br)S2)C(=O)C2=CC=CC=C12
InChIKey
InChIKey=IJATZUDTDQIXDZ-UHFFFAOYSA-N
Formula
C15H12BrNO3S
Mass
366.23
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
Indolyl carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolyl carboxylic acids and derivatives
Alternative Parents
Isoindolones Isoindoles Indoles 2,5-disubstituted thiophenes Aryl bromides Benzenoids Tertiary carboxylic acid amides Heteroaromatic compounds Lactams Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Carbonyl compounds Organic oxides Organobromides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolyl carboxylic acid derivative - Isoindolone - Indole - Isoindoline - Isoindole - Isoindole or derivatives - 2,5-disubstituted thiophene - Benzenoid - Aryl bromide - Aryl halide - Thiophene - Tertiary carboxylic acid amide - Heteroaromatic compound - Carboxamide group - Lactam - Carboxylic acid derivative - Carboxylic acid - Azacycle - Monocarboxylic acid or derivatives - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organobromide - Hydrocarbon derivative - Organohalogen compound - Organonitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolyl carboxylic acids and derivatives. These are compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an indole ring.
External Descriptors
Not available