Structure Information
Structure

Compound Identification

SMILES

CC1=NC=C(N1CCN1C(=O)C2C(NC(CC3=CNC4=CC=CC=C34)(C2C1=O)C(O)=O)C1=CC(OC(F)(F)F)=CC=C1)[N+]([O-])=O

InChIKey

InChIKey=PKOCNIBEUSLCDY-UHFFFAOYSA-N

Formula

C29H25F3N6O7

Mass

626.549

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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 - Alpha-amino acid - Alpha-amino acid or derivatives - 3-alkylindole - Indole - Indole or derivatives - 1,2,5-trisubstituted-imidazole - Phenoxy compound - Nitroaromatic compound - Trisubstituted imidazole - Imidazolyl carboxylic acid derivative - Pyrrolidine carboxylic acid or derivatives - Nitroimidazole - Phenol ether - Pyrrolidine carboxylic acid - Aralkylamine - N-substituted imidazole - Benzenoid - Pyrrolidone - Carboxylic acid imide, n-substituted - N-alkylpyrrolidine - Monocyclic benzene moiety - Substituted pyrrole - 2-pyrrolidone - Azole - Carboxylic acid imide - Dicarboximide - Imidazole - Heteroaromatic compound - Pyrrole - Amino acid or derivatives - Organic nitro compound - C-nitro compound - Amino acid - Lactam - Trihalomethane - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organic oxoazanium - Azacycle - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Organic salt - Alkyl halide - Organic oxygen compound - Halomethane - Alkyl fluoride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organofluoride - Amine - Organonitrogen compound - Organooxygen compound - Organic zwitterion - 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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