Structure Information
Structure

Compound Identification

SMILES

COC1=C(OC)C=C(CN2C(C)=C(C=C2C2=CC(Br)=CC=C2)C(N)=O)C=C1

InChIKey

InChIKey=SFKVIGDZQZYJPT-UHFFFAOYSA-N

Formula

C21H21BrN2O3

Mass

429.314

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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

Dimethoxybenzenes Pyrrole carboxamides Phenoxy compounds Anisoles Bromobenzenes Alkyl aryl ethers Aryl bromides Vinylogous amides Heteroaromatic compounds Primary carboxylic acid amides Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-phenylpyrrole - Dimethoxybenzene - O-dimethoxybenzene - Anisole - Phenol ether - Pyrrole-3-carboxamide - Pyrrole-3-carboxylic acid or derivatives - Phenoxy compound - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl halide - Benzenoid - Aryl bromide - Monocyclic benzene moiety - Vinylogous amide - Heteroaromatic compound - Primary carboxylic acid amide - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - 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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