Compound Identification
SMILES
[O-]C(=C1C(N(CCC[N+]2=CNC=C2)C(=O)C1=O)C1=CC=CC=C1Cl)C1=CC=C(Br)C=C1
InChIKey
InChIKey=HYDAKZKIMMTYLM-UHFFFAOYSA-N
Formula
C23H19BrClN3O3
Mass
500.78
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 Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl bromides Aryl chlorides N-substituted imidazoles N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Cyclic ketones Lactams Azacyclic compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organobromides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Halobenzene - Chlorobenzene - Bromobenzene - N-substituted imidazole - Aryl bromide - Aryl chloride - Aryl halide - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Monocyclic benzene moiety - Imidazole - Tertiary carboxylic acid amide - Pyrrole - Azole - Vinylogous acid - Heteroaromatic compound - Cyclic ketone - Carboxamide group - Lactam - Ketone - Azacycle - Carboxylic acid derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic zwitterion - Carbonyl group - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organobromide - 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