Compound Identification
SMILES
OC(=C1C(N(CCCN2C=CN=C2)C(=O)C1=O)C1=CC(O)=CC=C1)C1=CC=NC=C1
InChIKey
InChIKey=WMMSQUQQNYROPL-UHFFFAOYSA-N
Formula
C22H20N4O4
Mass
404.426
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
1-hydroxy-2-unsubstituted benzenoids 1-hydroxy-4-unsubstituted benzenoids Benzene and substituted derivatives N-alkylpyrrolidines N-substituted imidazoles Pyridines and derivatives Pyrrolidine-2-ones Pyrrolidine-3-ones Tertiary carboxylic acid amides Heteroaromatic compounds Vinylogous acids Pyrroles Lactams Cyclic ketones Azacyclic compounds Enols Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Monocyclic benzene moiety - N-substituted imidazole - Pyridine - Pyrrolidone - 2-pyrrolidone - Benzenoid - 3-pyrrolidone - N-alkylpyrrolidine - Azole - Imidazole - Heteroaromatic compound - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Lactam - Ketone - Carboxamide group - Cyclic ketone - Enol - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - 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