Compound Identification
SMILES
CC1=CC=CC=C1N1C(=O)CC(N2CCN(CC2)S(=O)(=O)C2=CC=C(Cl)C=C2)C1=O
InChIKey
InChIKey=DJRCUVYRSUIIBS-UHFFFAOYSA-N
Formula
C21H22ClN3O4S
Mass
447.93
Taxonomic Classification
Taxonomy Tree
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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 Benzenesulfonamides Benzenesulfonyl compounds Toluenes Chlorobenzenes N-alkylpiperazines Aryl chlorides Pyrrolidine-2-ones Organosulfonamides N-substituted carboxylic acid imides Sulfonyls Pyrroles Dicarboximides Trialkylamines Lactams Azacyclic compounds Organic oxides Carbonyl compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Benzenesulfonamide - Benzenesulfonyl group - Halobenzene - Chlorobenzene - Toluene - N-alkylpiperazine - Carboxylic acid imide, n-substituted - Benzenoid - Monocyclic benzene moiety - Aryl halide - Organosulfonic acid amide - 1,4-diazinane - Aryl chloride - 2-pyrrolidone - Pyrrolidone - Piperazine - Pyrrole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Dicarboximide - Sulfonyl - Carboxylic acid imide - Amino acid or derivatives - Tertiary aliphatic amine - Tertiary amine - Lactam - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Amine - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - 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