Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=YHHRUSVNGIXBHH-UHFFFAOYSA-N

Formula

C20H19BrN2O5

Mass

447.285

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Indoles and derivatives

Subclass

Indolyl carboxylic acids and derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Indole-3-acetic acid derivatives

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Indole-3-acetic acid derivative - 1-phenylpyrrole - 3-alkylindole - Nitrotoluene - Indole - Nitrobenzene - Nitroaromatic compound - Toluene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Substituted pyrrole - Benzenoid - Tertiary alcohol - Heteroaromatic compound - Pyrrole - Organic nitro compound - Carboxylic acid ester - C-nitro compound - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organohalogen compound - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Alcohol - Organic zwitterion - Aromatic alcohol - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as indole-3-acetic acid derivatives. These are compounds containing an acetic acid (or a derivative) linked to the C3 carbon atom of an indole.

External Descriptors

Not available

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