Compound Identification
SMILES
CCOC(=O)C(=O)C1=CC2=C(C=CC(Cl)=C2)N1S(=O)(=O)C1=CC=CC=C1
InChIKey
InChIKey=NKBWXTIBXWBFBH-UHFFFAOYSA-N
Formula
C18H14ClNO5S
Mass
391.82
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
Benzenesulfonamides Indoles Benzenesulfonyl compounds Aryl ketones Substituted pyrroles Alpha-keto acids and derivatives Aryl chlorides Sulfonyls Organosulfonic acids and derivatives Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolyl carboxylic acid derivative - Benzenesulfonamide - Indole - Benzenesulfonyl group - Aryl ketone - Keto acid - Alpha-keto acid - Aryl chloride - Substituted pyrrole - Benzenoid - Monocyclic benzene moiety - Aryl halide - Sulfonyl - Pyrrole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Heteroaromatic compound - Carboxylic acid ester - Ketone - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Organochloride - 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