Compound Identification
SMILES
COC1=C(F)C=C(C=C1)C(O)=C1[C@H](N(CC[NH+](C)C)C(=O)C1=O)C1=CC(O)=CC=C1
InChIKey
InChIKey=IPTIQZBMQLDZSX-LJQANCHMSA-O
Formula
C22H24FN2O5
Mass
415.441
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
Anisoles Phenoxy compounds Methoxybenzenes 1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Alkyl aryl ethers Fluorobenzenes Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl fluorides N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Cyclic ketones Amino acids and derivatives Trialkylamines Lactams Enols Azacyclic compounds Organofluorides Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Fluorobenzene - Phenol - Aryl fluoride - Aryl halide - Benzenoid - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Monocyclic benzene moiety - Pyrrole - Quaternary ammonium salt - Tertiary carboxylic acid amide - Vinylogous acid - Carboxamide group - Lactam - Ketone - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Amino acid or derivatives - Azacycle - Carboxylic acid derivative - Enol - Ether - Organic oxygen compound - Amine - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organofluoride - Organohalogen compound - 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