Structure Information
Structure

Compound Identification

SMILES

COC(=O)C1=CC=C(C=C1)C1N(C(=O)C(=O)C1=C(O)C1=CC=C(OCC2=CC=CC(C)=C2)C=C1)C1=NN=C(SCC2=CC=CC=C2Cl)S1

InChIKey

InChIKey=OEAHRQKHHDVAMI-UHFFFAOYSA-N

Formula

C36H28ClN3O6S2

Mass

698.21

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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 - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Phenoxy compound - Aryl thioether - Phenol ether - Alkyl aryl ether - Toluene - Halobenzene - Alkylarylthioether - Chlorobenzene - Aryl halide - Aryl chloride - Pyrrolidone - Benzenoid - 3-pyrrolidone - 2-pyrrolidone - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Thiadiazole - Pyrrole - Methyl ester - Vinylogous acid - Heteroaromatic compound - Azole - Cyclic ketone - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Azacycle - Ether - Enol - Sulfenyl compound - Thioether - Carboxylic acid derivative - Organonitrogen compound - Carbonyl group - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - 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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