Structure Information
Structure

Compound Identification

SMILES

COC1=C(O)C(Br)=CC(=C1)C1N(CCCN2CCOCC2)C(=O)C(=O)C1=C(O)C1=C(C)C=CC(C)=C1

InChIKey

InChIKey=KIOGQHHIXMXBPS-UHFFFAOYSA-N

Formula

C27H31BrN2O6

Mass

559.457

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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 - Methoxyphenol - Phenoxy compound - Anisole - P-xylene - Xylene - 2-bromophenol - 2-halophenol - Methoxybenzene - Phenol ether - Alkyl aryl ether - Halobenzene - Bromobenzene - Phenol - Morpholine - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Oxazinane - Benzenoid - N-alkylpyrrolidine - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Amino acid or derivatives - Cyclic ketone - Ketone - Carboxamide group - Lactam - Tertiary amine - Tertiary aliphatic amine - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Enol - Ether - Organonitrogen compound - Carbonyl group - Organooxygen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - 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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