Compound Identification
SMILES
COC1=CC=CC(=C1)C1N(CCC2=CN=CN2)C(=O)C(=O)\C1=C(/O)C1=CC=C(F)C=C1
InChIKey
InChIKey=HNESBQXBVRNRLA-VZCXRCSSSA-N
Formula
C23H20FN3O4
Mass
421.428
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 Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Fluorobenzenes Pyrrolidine-2-ones Aryl fluorides Pyrrolidine-3-ones N-alkylpyrrolidines Pyrroles Vinylogous acids Tertiary carboxylic acid amides Imidazoles Heteroaromatic compounds Cyclic ketones Lactams Enols Azacyclic compounds Organonitrogen compounds Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Halobenzene - Fluorobenzene - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Imidazole - Heteroaromatic compound - Azole - Vinylogous acid - Pyrrole - Tertiary carboxylic acid amide - Ketone - Cyclic ketone - Lactam - Carboxamide group - Azacycle - Carboxylic acid derivative - Enol - Ether - Organic oxygen compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organofluoride - Organohalogen compound - 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