Structure Information
Structure

Compound Identification

SMILES

COC1=CC=C(N\C(C)=C2/C(N(CCO)C(=O)C2=O)C2=CC=C(Br)C=C2)C=C1

InChIKey

InChIKey=QHMYSAQNRNGZBQ-QGOAFFKASA-N

Formula

C21H21BrN2O4

Mass

445.313

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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 - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aniline or substituted anilines - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - Pyrrolidone - Benzenoid - N-alkylpyrrolidine - Monocyclic benzene moiety - 3-pyrrolidone - 2-pyrrolidone - Tertiary carboxylic acid amide - Pyrrole - Vinylogous amide - Amino acid or derivatives - Cyclic ketone - Carboxamide group - Ketone - Lactam - Azacycle - Alkanolamine - Carboxylic acid derivative - Enamine - Ether - Secondary amine - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Primary alcohol - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Amine - Alcohol - 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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