Compound Identification
SMILES
COC1=C(O)C=CC(=C1)[C@H]1N(CCCN2CCOCC2)C(=O)C(=O)C1=C([O-])C1=CC(F)=C(C)C=C1
InChIKey
InChIKey=XHBVFCIZHMSNEU-HSZRJFAPSA-M
Formula
C26H28FN2O6
Mass
483.517
Taxonomic Classification
Taxonomy Tree
-
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
Methoxyphenols Anisoles Methoxybenzenes Phenoxy compounds 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers Toluenes Fluorobenzenes Aryl fluorides Pyrrolidine-3-ones Pyrrolidine-2-ones Morpholines N-alkylpyrrolidines Tertiary carboxylic acid amides Pyrroles Vinylogous acids Amino acids and derivatives Lactams Trialkylamines Cyclic ketones Dialkyl ethers Azacyclic compounds Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organofluorides Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Methoxyphenol - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Fluorobenzene - Toluene - Halobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Morpholine - Oxazinane - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Pyrrole - Tertiary carboxylic acid amide - Vinylogous acid - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Azacycle - Ether - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Amine - Carbonyl group - Organic oxygen compound - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organic anion - 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