Compound Identification
SMILES
COC(=O)C1=NNC2(C1C(=O)N(C2=O)C1=CC=CC(C)=C1C)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=DXKGBRWHXUWSQX-UHFFFAOYSA-N
Formula
C21H18ClN3O4
Mass
411.84
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
Alpha amino acids and derivatives o-Xylenes Pyrrolopyrazoles Chlorobenzenes Pyrrolidine-2-ones Aryl chlorides N-substituted carboxylic acid imides Pyrroles Pyrazolines Methyl esters Dicarboximides N-alkylated hydrazones Lactams Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - 3-phenylpyrrolidine - Alpha-amino acid or derivatives - O-xylene - Xylene - Pyrrolopyrazole - Halobenzene - Chlorobenzene - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - 2-pyrrolidone - Pyrrolidone - Aryl halide - Aryl chloride - Benzenoid - Methyl ester - Pyrrole - Pyrazoline - Dicarboximide - Carboxylic acid imide - Carboxylic acid ester - N-alkylated hydrazone - Lactam - Hydrazone - Azacycle - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen 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