Structure Information
Structure

Compound Identification

SMILES

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

InChIKey

InChIKey=MJRITGQMTZSHBC-UHFFFAOYSA-N

Formula

C26H24N4O7

Mass

504.499

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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

Nitrobenzenes Pyrrole carboxylic acids and derivatives Nitroaromatic compounds Substituted pyrroles Pyrrolidine-3-ones Pyrrolidine-2-ones Pyridinium derivatives N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Heteroaromatic compounds Tertiary amines Amino acids and derivatives Carboxylic acid esters Cyclic ketones Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic salts Organic zwitterions Hydrocarbon derivatives Organic oxides

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

2-phenylpyrrolidine - Nitrobenzene - Pyrrole-2-carboxylic acid or derivatives - Nitroaromatic compound - N-alkylpyrrolidine - Substituted pyrrole - Benzenoid - 3-pyrrolidone - Pyridine - Pyridinium - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Tertiary carboxylic acid amide - Pyrrole - Heteroaromatic compound - Vinylogous acid - Amino acid or derivatives - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - C-nitro compound - Organic nitro compound - Tertiary amine - Cyclic ketone - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Amine - Carbonyl group - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organic zwitterion - Organonitrogen compound - Organooxygen compound - 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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