Structure Information
Structure

Compound Identification

SMILES

CC1COCCN1N1C(=O)CC(C1=O)C1=CC(Br)=CC=C1

InChIKey

InChIKey=QETGJFOMGSJCSN-UHFFFAOYSA-N

Formula

C15H17BrN2O3

Mass

353.216

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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

Bromobenzenes Pyrrolidine-2-ones Aryl bromides Morpholines Pyrroles Dicarboximides Carboxylic acid hydrazides Lactams Azacyclic compounds Dialkyl ethers Oxacyclic compounds Hydrocarbon derivatives Organonitrogen compounds Carbonyl compounds Organopnictogen compounds Organobromides Organic oxides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

3-phenylpyrrolidine - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Morpholine - Benzenoid - 2-pyrrolidone - Pyrrolidone - Oxazinane - Dicarboximide - Pyrrole - Carboxylic acid hydrazide - Lactam - Azacycle - Oxacycle - Ether - Dialkyl ether - Carboxylic acid derivative - Organobromide - Organohalogen compound - Organic nitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - 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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