Compound Identification
SMILES
ClC1=CC(=CC(Cl)=C1)N1C(=O)CC([NH+]2CCN(CC2)C(=O)C2=CC=CC=C2)C1=O
InChIKey
InChIKey=XUJSXIYVPVZCQY-UHFFFAOYSA-O
Formula
C21H20Cl2N3O3
Mass
433.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Alpha amino acids and derivatives Benzamides Benzoyl derivatives Dichlorobenzenes N-alkylpiperazines Aryl chlorides Pyrrolidine-2-ones N-substituted carboxylic acid imides Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Dicarboximides Trialkylamines Lactams Azacyclic compounds Organochlorides Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Benzoic acid or derivatives - Benzamide - Benzoyl - 1,3-dichlorobenzene - Chlorobenzene - Halobenzene - N-alkylpiperazine - Benzenoid - Carboxylic acid imide, n-substituted - 1,4-diazinane - 2-pyrrolidone - Pyrrolidone - Aryl halide - Piperazine - Aryl chloride - Monocyclic benzene moiety - Carboxylic acid imide - Dicarboximide - Tertiary carboxylic acid amide - Quaternary ammonium salt - Pyrrole - Amino acid or derivatives - Tertiary aliphatic amine - Lactam - Tertiary amine - Carboxamide group - Azacycle - Carboxylic acid derivative - Organic nitrogen compound - Amine - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic cation - 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