Structure Information
Structure

Compound Identification

SMILES

COC1=CC=CC(C2NC(CC3=CC=C(C=C3)[N+]([O-])=O)(C3C2C(=O)N(CCSC2=CC=CC=C2)C3=O)C(O)=O)=C1OCC1=CC=CC=C1

InChIKey

InChIKey=OZAKXZZDNZBQPU-UHFFFAOYSA-N

Formula

C36H33N3O8S

Mass

667.73

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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 - 3-phenylpropanoic-acid - Alpha-amino acid - Alpha-amino acid or derivatives - Amphetamine or derivatives - Nitrobenzene - Thiophenol ether - Phenoxy compound - Aryl thioether - Nitroaromatic compound - Anisole - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine carboxylic acid - Methoxybenzene - Phenol ether - Alkyl aryl ether - Aralkylamine - Alkylarylthioether - Carboxylic acid imide, n-substituted - N-alkylpyrrolidine - Monocyclic benzene moiety - Benzenoid - Pyrrolidone - 2-pyrrolidone - Carboxylic acid imide - Dicarboximide - Pyrrole - Lactam - Organic nitro compound - C-nitro compound - Amino acid - Amino acid or derivatives - Sulfenyl compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Thioether - Monocarboxylic acid or derivatives - Secondary amine - Ether - Carboxylic acid derivative - Secondary aliphatic amine - Carboxylic acid - Organic zwitterion - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organic salt - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Amine - Organosulfur compound - Organic oxide - 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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