Structure Information
Structure

Compound Identification

SMILES

COC1=NC=C(C=C1)N1C2=C(C=C1C1=CC=C(Br)C=C1)C(=O)CC(C)C2

InChIKey

InChIKey=CCAIZEFJGDVDAT-UHFFFAOYSA-N

Formula

C21H19BrN2O2

Mass

411.299

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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

Indoles and derivatives Aryl alkyl ketones Bromobenzenes Alkyl aryl ethers Pyridines and derivatives Aryl bromides Vinylogous amides Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

2-phenylpyrrole - Indole or derivatives - Aryl alkyl ketone - Aryl ketone - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Heteroaromatic compound - Vinylogous amide - Ketone - Azacycle - Ether - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic 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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