Compound Identification
SMILES
OCCSC1N(CC(O)=O)CC2=CC=CC=C12
InChIKey
InChIKey=DGLGSCDBZRZIQH-UHFFFAOYSA-N
Formula
C12H15NO3S
Mass
253.32
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
Indolyl carboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Indolyl carboxylic acids and derivatives
Alternative Parents
Alpha amino acids and derivatives Isoindolines Isoindoles Indoles Benzenoids Sulfenyl compounds Monocarboxylic acids and derivatives Dialkylthioethers Carboxylic acids Azacyclic compounds Primary alcohols Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolyl carboxylic acid derivative - Alpha-amino acid or derivatives - Indole - Isoindoline - Isoindole - Isoindole or derivatives - Benzenoid - Carboxylic acid derivative - Carboxylic acid - Azacycle - Dialkylthioether - Monocarboxylic acid or derivatives - Thioether - Sulfenyl compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Alcohol - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Primary alcohol - Organic nitrogen compound - Organic oxygen compound - 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