Compound Identification
SMILES
[O-]C(=C1C(N(CCC[NH+]2CCOCC2)C(=O)C1=O)C1=CC=C(Br)C=C1)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=KFGFEOVDFBLXCW-UHFFFAOYSA-N
Formula
C24H24BrClN2O4
Mass
519.82
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Bromobenzenes Chlorobenzenes Aryl bromides Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl chlorides Morpholines N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Amino acids and derivatives Trialkylamines Cyclic ketones Lactams Dialkyl ethers Oxacyclic compounds Azacyclic compounds Hydrocarbon derivatives Organobromides Organochlorides Organic zwitterions Organic salts Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Quaternary ammonium salt - Vinylogous acid - Tertiary carboxylic acid amide - Pyrrole - Cyclic ketone - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Ketone - Lactam - Amino acid or derivatives - Azacycle - Oxacycle - Dialkyl ether - Carboxylic acid derivative - Ether - Amine - Organic oxide - Organic zwitterion - Organic oxygen compound - Organic salt - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - 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