Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(C)(OC)C(=O)C1=C(C=CN1)C1=C(C)C=C(Br)C=C1

InChIKey

InChIKey=DIXISLHVGHWQBZ-UHFFFAOYSA-N

Formula

C18H20BrNO4

Mass

394.265

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrroles

Subclass

Substituted pyrroles

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrroles

Alternative Parents

Aryl alkyl ketones Toluenes Fatty acid esters Bromobenzenes Beta-keto acids and derivatives Aryl bromides Heteroaromatic compounds Carboxylic acid esters Monocarboxylic acids and derivatives Dialkyl ethers Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

3-phenylpyrrole - Aryl alkyl ketone - Aryl ketone - Beta-keto acid - Bromobenzene - Toluene - Fatty acid ester - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Keto acid - Heteroaromatic compound - Carboxylic acid ester - Ketone - Ether - Dialkyl ether - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organic nitrogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.

External Descriptors

Not available

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