Compound Identification
SMILES
CCOC(=O)C[C@H](NC(=O)N[C@H]1CCN(C1=O)C1=CC=C(C=C1)C#N)C1=CC=CC=C1
InChIKey
InChIKey=ZRIKFNULVUVKLO-PMACEKPBSA-N
Formula
C23H24N4O4
Mass
420.469
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
-
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
Alpha amino acids and derivatives Benzonitriles Fatty acid esters Pyrrolidine-2-ones Tertiary carboxylic acid amides Pyrroles Ureas Lactams Carboxylic acid esters Nitriles Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Benzonitrile - Fatty acid ester - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Pyrrolidone - 2-pyrrolidone - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid ester - Lactam - Urea - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Cyanide - 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