Structure Information
Structure

Compound Identification

SMILES

[Cl-].CCOC(=O)C1=C(C[NH2+]CC2=CC=CC=C2)N(C)C2=C1C=C(OS(=O)(=O)C1=CC=C(C)C=C1)C=C2

InChIKey

InChIKey=HEFLRNDVJVOIDB-UHFFFAOYSA-N

Formula

C27H29ClN2O5S

Mass

529.05

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indolecarboxylic acid derivative - Benzenesulfonate ester - P-methylbenzenesulfonate - N-alkylindole - Benzenesulfonate - Tosyl compound - Arylsulfonic acid or derivatives - Benzenesulfonyl group - Indole - Pyrrole-3-carboxylic acid or derivatives - Phenylmethylamine - Benzylamine - Toluene - Aralkylamine - Monocyclic benzene moiety - Substituted pyrrole - Organosulfonic acid ester - N-methylpyrrole - Benzenoid - Sulfonyl - Organosulfonic acid or derivatives - Heteroaromatic compound - Vinylogous amide - Pyrrole - Organic sulfonic acid or derivatives - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Secondary aliphatic amine - Azacycle - Monocarboxylic acid or derivatives - Secondary amine - Organic oxygen compound - Organic chloride salt - Organic nitrogen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic salt - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - 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

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