Compound Identification
SMILES
COC1=CC(C)=C(C=C1)C(\O)=C1\[C@@H](N(CCC[NH+](C)C)C(=O)C1=O)C1=CC=C(F)C=C1
InChIKey
InChIKey=PZXNYCOSTFZIGW-MRJHHRETSA-O
Formula
C24H28FN2O4
Mass
427.496
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
Methoxybenzenes Anisoles Phenoxy compounds Alkyl aryl ethers Fluorobenzenes Toluenes Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl fluorides N-alkylpyrrolidines Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Vinylogous acids Amino acids and derivatives Cyclic ketones Lactams Trialkylamines Azacyclic compounds Enols Hydrocarbon derivatives Organofluorides Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Toluene - Halobenzene - Fluorobenzene - 3-pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Aryl fluoride - Pyrrolidone - Benzenoid - Aryl halide - Monocyclic benzene moiety - Tertiary carboxylic acid amide - Pyrrole - Quaternary ammonium salt - Vinylogous acid - Amino acid or derivatives - Carboxamide group - Cyclic ketone - Ketone - Lactam - Tertiary aliphatic amine - Tertiary amine - Ether - Enol - Carboxylic acid derivative - Azacycle - Organic oxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - 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