Structure Information
Structure

Compound Identification

SMILES

CCCC(C(=O)NCC1=CC=C(C=C1)N1C=C(Br)C=C1C#N)C1=C(C=CC(Cl)=N1)[N+]([O-])=O

InChIKey

InChIKey=JNJOOSHPRUEIIE-UHFFFAOYSA-N

Formula

C22H19BrClN5O3

Mass

516.78

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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

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

1-phenylpyrrole - Nitroaromatic compound - 2-halopyridine - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - N-acyl-amine - Pyridine - Benzenoid - Fatty acyl - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Organic nitro compound - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Azacycle - Carbonitrile - Nitrile - Organic oxoazanium - Organic oxygen compound - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Carbonyl group - Organic salt - Organooxygen compound - Organic nitrogen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Cyanide - 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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