Structure Information
Structure

Compound Identification

SMILES

C[C@H](NC(=O)C(O)[C@@H](O)C(=O)N1CCCC1C1=CC(Cl)=CC=C1)C1=CC=C(Br)C=C1

InChIKey

InChIKey=RIRMSETZIFRGDP-QHQDJBGNSA-N

Formula

C22H24BrClN2O4

Mass

495.8

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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

N-acylpyrrolidines Bromobenzenes Chlorobenzenes Aryl bromides Aryl chlorides Monosaccharides N-acyl amines Tertiary carboxylic acid amides Pyrroles Secondary carboxylic acid amides Amino acids and derivatives 1,2-diols Tertiary amines Secondary alcohols Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Organobromides Organochlorides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-phenylpyrrolidine - N-acylpyrrolidine - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Fatty amide - Monosaccharide - N-acyl-amine - Benzenoid - Fatty acyl - Tertiary carboxylic acid amide - Pyrrole - Amino acid or derivatives - Tertiary amine - Secondary carboxylic acid amide - Secondary alcohol - 1,2-diol - Carboxamide group - Carboxylic acid derivative - Azacycle - Alcohol - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organochloride - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Aromatic heteromonocyclic 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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