Compound Identification
SMILES
COC1=CC=C(C=C1)C1N(CCC[NH+](C)C)C(=O)C(=O)C1=C([O-])C1=C(C)N=C2C=CC=CN12
InChIKey
InChIKey=RTAIETSIFUKUBK-UHFFFAOYSA-N
Formula
C25H28N4O4
Mass
448.523
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Imidazo[1,2-a]pyridines Imidazopyridines Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Pyridines and derivatives N-alkylpyrrolidines N-substituted imidazoles Vinylogous acids Heteroaromatic compounds Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Trialkylamines Amino acids and derivatives Lactams Cyclic ketones Azacyclic compounds Hydrocarbon derivatives Organic zwitterions Organic salts Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Imidazo[1,2-a]pyridine - Imidazopyridine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - N-substituted imidazole - Pyridine - Benzenoid - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - 3-pyrrolidone - Azole - Imidazole - Heteroaromatic compound - Vinylogous acid - Pyrrole - Quaternary ammonium salt - Tertiary carboxylic acid amide - Tertiary amine - Tertiary aliphatic amine - Cyclic ketone - Carboxamide group - Ketone - Amino acid or derivatives - Lactam - Azacycle - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organic salt - Organooxygen compound - Carbonyl group - Organic zwitterion - Organic oxide - Organic oxygen compound - Amine - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteropolycyclic 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