Structure Information
Structure

Compound Identification

SMILES

COCCCN1C(\C(=C(/O)C2=C(C)C=C(OCC3=CC=CC=C3)C=C2)C(=O)C1=O)C1=CC=C(Br)C=C1

InChIKey

InChIKey=KGWADFOADUCTSV-IMVLJIQESA-N

Formula

C29H28BrNO5

Mass

550.449

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