Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=C(C)C(C([O-])=C2C(N(CC3=C[NH+]=CC=C3)C(=O)C2=O)C2=CC=C(Br)C=C2)=C(C)N1

InChIKey

InChIKey=LSUBWXLGGBJQSK-UHFFFAOYSA-N

Formula

C25H22BrN3O5

Mass

524.371

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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 - Pyrrole-2-carboxylic acid or derivatives - Halobenzene - Bromobenzene - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Substituted pyrrole - Aryl bromide - Monocyclic benzene moiety - Aryl halide - Benzenoid - Pyridine - Pyridinium - N-alkylpyrrolidine - Pyrrole - Tertiary carboxylic acid amide - Vinylogous acid - Methyl ester - Heteroaromatic compound - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Cyclic ketone - Tertiary amine - Azacycle - Carboxylic acid derivative - Organohalogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Organobromide - Organonitrogen compound - Organooxygen compound - Organic salt - Organic zwitterion - Organic oxide - Hydrocarbon derivative - 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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