Structure Information
Structure

Compound Identification

SMILES

CCN(CC)CCN1C(C(=C(O)C2=CC(C)=C(OCC(C)C)C=C2)C(=O)C1=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=KFKNSIWDWJZLHF-UHFFFAOYSA-N

Formula

C28H35BrN2O4

Mass

543.502

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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 heteromonocyclic compounds

Substituents

2-phenylpyrrolidine - Phenoxy compound - Phenol ether - Alkyl aryl ether - Bromobenzene - Halobenzene - Toluene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Cyclic ketone - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Ketone - Lactam - Azacycle - Carboxylic acid derivative - Enol - Ether - Organic nitrogen compound - Organobromide - Carbonyl group - Amine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organohalogen 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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