Compound Identification
SMILES
COC(=O)C1=C(C)C(C([O-])=C2C(N(CCC[N+]3=CNC=C3)C(=O)C2=O)C2=CC=C(C)C=C2)=C(C)N1
InChIKey
InChIKey=ZNZZBGZOKMMYFK-UHFFFAOYSA-N
Formula
C26H28N4O5
Mass
476.533
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
Pyrrole carboxylic acids and derivatives Toluenes Substituted pyrroles Pyrrolidine-3-ones Pyrrolidine-2-ones N-alkylpyrrolidines N-substituted imidazoles Vinylogous acids Tertiary carboxylic acid amides Heteroaromatic compounds Methyl esters Cyclic ketones Lactams Azacyclic compounds Organic zwitterions Hydrocarbon derivatives Organonitrogen compounds Organic salts Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Pyrrole-2-carboxylic acid or derivatives - Toluene - 2-pyrrolidone - 3-pyrrolidone - Substituted pyrrole - N-alkylpyrrolidine - Pyrrolidone - Benzenoid - Monocyclic benzene moiety - N-substituted imidazole - Pyrrole - Methyl ester - Tertiary carboxylic acid amide - Vinylogous acid - Imidazole - Heteroaromatic compound - Azole - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Cyclic ketone - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organooxygen compound - Organic salt - Organic zwitterion - 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