Compound Identification
SMILES
COC(=O)C1=C(C)C(C([O-])=C2C(N(CCC[N+]3=CNC=C3)C(=O)C2=O)C2=CC=CC=C2F)=C(C)N1
InChIKey
InChIKey=HGYJHNKUPBYECE-UHFFFAOYSA-N
Formula
C25H25FN4O5
Mass
480.496
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Pyrrole carboxylic acids and derivatives Fluorobenzenes Substituted pyrroles Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl fluorides N-substituted imidazoles N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Heteroaromatic compounds Methyl esters Cyclic ketones Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organofluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Pyrrole-2-carboxylic acid or derivatives - Fluorobenzene - Halobenzene - N-substituted imidazole - Aryl fluoride - Monocyclic benzene moiety - Aryl halide - Benzenoid - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - 3-pyrrolidone - Substituted pyrrole - Heteroaromatic compound - Imidazole - Vinylogous acid - Pyrrole - Azole - Methyl ester - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Lactam - Cyclic ketone - Carboxylic acid ester - Azacycle - Carboxylic acid derivative - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic zwitterion - Organic salt - 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