Compound Identification
SMILES
CCN1C=C(C2CCN(C2)S(=O)(=O)C2=CC=C(OC(C)C)C=C2)C2=C1C=C(C=C2)C(=O)OCC=C
InChIKey
InChIKey=ZQAQBAFTPJECTN-UHFFFAOYSA-N
Formula
C27H32N2O5S
Mass
496.62
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Indoles and derivatives
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Subclass
Indolecarboxylic acids and derivatives
- Level 5 Indolecarboxylic acids
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Subclass
Indolecarboxylic acids and derivatives
-
Class
Indoles and derivatives
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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
Alternative Parents
3-alkylindoles Benzenesulfonamides N-alkylindoles Benzenesulfonyl compounds Phenol ethers Phenoxy compounds Alkyl aryl ethers Organosulfonamides Substituted pyrroles Pyrrolidines Heteroaromatic compounds Sulfonyls Carboxylic acid esters Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indolecarboxylic acid - Benzenesulfonamide - N-alkylindole - 3-alkylindole - Benzenesulfonyl group - Indole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Monocyclic benzene moiety - Substituted pyrrole - Organosulfonic acid amide - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Sulfonyl - Pyrrolidine - Pyrrole - Heteroaromatic compound - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Ether - Organic oxide - Organosulfur compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indolecarboxylic acids. These are compounds containing a carboxylic acid group linked to an indole.
External Descriptors
Not available