Structure Information
Structure

Compound Identification

SMILES

FC1=C(F)C(F)=C(N2C(=O)[C@H]3N=NN(CC(=O)N4N=C(C[C@H]4C4=CC=CC=C4)C4=CC=C(Br)C=C4)[C@@H]3C2=O)C(F)=C1F

InChIKey

InChIKey=HOIKECWWQGNFEP-KXXXHFJOSA-N

Formula

C27H16BrF5N6O3

Mass

647.36

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Pyrrolidines

Subclass

Phenylpyrrolidines

Intermediate Tree Nodes

Not available

Direct Parent

Phenylpyrrolidines

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

1-phenylpyrrolidine - Alpha-amino acid or derivatives - Halobenzene - Fluorobenzene - Bromobenzene - Carboxylic acid imide, n-substituted - Aryl bromide - Aryl fluoride - Pyrrolidone - 2-pyrrolidone - Benzenoid - Monocyclic benzene moiety - Aryl halide - Triazoline - Dicarboximide - Carboxylic acid imide - Pyrazoline - Pyrrole - Lactam - Azacycle - Organic 1,3-dipolar compound - Carboxylic acid derivative - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organic oxide - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organonitrogen compound - Organofluoride - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.

External Descriptors

Not available

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