Compound Identification
SMILES
COCCN1C(C(=C(O)C2=CC=C(C=C2)S(=O)(=O)N(C)C)C(=O)C1=O)C1=CC(Br)=CC=C1
InChIKey
InChIKey=UORNTBAUOBRXIQ-UHFFFAOYSA-N
Formula
C22H23BrN2O6S
Mass
523.4
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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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
Benzenesulfonamides Benzenesulfonyl compounds Bromobenzenes Aryl bromides Pyrrolidine-3-ones N-alkylpyrrolidines Organosulfonamides Pyrrolidine-2-ones Aminosulfonyl compounds Vinylogous acids Pyrroles Tertiary carboxylic acid amides Lactams Cyclic ketones Azacyclic compounds Enols Dialkyl ethers Organic oxides Hydrocarbon derivatives Organobromides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Benzenesulfonamide - Benzenesulfonyl group - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Organosulfonic acid amide - Vinylogous acid - Pyrrole - Aminosulfonyl compound - Tertiary carboxylic acid amide - Sulfonyl - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Cyclic ketone - Carboxamide group - Lactam - Ketone - Azacycle - Carboxylic acid derivative - Dialkyl ether - Enol - Ether - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organosulfur 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