Structure Information
Structure

Compound Identification

SMILES

CC[NH+](CC)CCCN1C(C(=C([O-])C2=CC3=C(OC(C)C3)C=C2)C(=O)C1=O)C1=CC=C(Cl)C=C1

InChIKey

InChIKey=VEKMSDZCCLFOSK-UHFFFAOYSA-N

Formula

C27H31ClN2O4

Mass

483.01

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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 heteropolycyclic compounds

Substituents

2-phenylpyrrolidine - Coumaran - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - Benzenoid - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Vinylogous acid - Pyrrole - Quaternary ammonium salt - Tertiary carboxylic acid amide - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Amino acid or derivatives - Carboxamide group - Lactam - Ketone - Carboxylic acid derivative - Oxacycle - Ether - Azacycle - Organic zwitterion - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Organic salt - Aromatic heteropolycyclic 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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