Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C1=C(C)N(CC(O)C2=CC=C(C=C2)[N+]([O-])=O)C2=C1C(C)=CC(O)=C2

InChIKey

InChIKey=MASRFBMAYPEWRI-UHFFFAOYSA-N

Formula

C21H22N2O6

Mass

398.415

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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 - Hydroxyindole - N-alkylindole - Nitrobenzene - Indole - Pyrrole-3-carboxylic acid or derivatives - Nitroaromatic compound - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Heteroaromatic compound - Vinylogous amide - Pyrrole - C-nitro compound - Organic nitro compound - Secondary alcohol - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organooxygen compound - Alcohol - Organic oxygen compound - Organic oxide - Organic zwitterion - Aromatic alcohol - 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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