Compound Identification
SMILES
COC(=O)C1=CC2=C(C=CC(C[C@@H](C)NC[C@H](O)C3=CC(Cl)=CC=C3)=C2)N1CC1=CC=C(C=C1)S(C)(=O)=O
InChIKey
InChIKey=BDXQDEABQNMWFN-GDJIYFAZSA-N
Formula
C29H31ClN2O5S
Mass
555.09
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 Benzenesulfonyl compounds Pyrrole carboxylic acids and derivatives Aralkylamines Chlorobenzenes Substituted pyrroles Aryl chlorides Sulfones Methyl esters Heteroaromatic compounds Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Dialkylamines Azacyclic compounds Aromatic alcohols Hydrocarbon derivatives Organic oxides Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid derivative - N-alkylindole - Indole - Benzenesulfonyl group - Pyrrole-2-carboxylic acid or derivatives - Aralkylamine - Halobenzene - Chlorobenzene - Benzenoid - Monocyclic benzene moiety - Substituted pyrrole - Aryl chloride - Aryl halide - Pyrrole - Methyl ester - Sulfonyl - Sulfone - Heteroaromatic compound - 1,2-aminoalcohol - Amino acid or derivatives - Carboxylic acid ester - Secondary alcohol - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Secondary amine - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Amine - Alcohol - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Aromatic alcohol - Organonitrogen compound - Organohalogen compound - Organochloride - 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