Compound Identification
SMILES
ClC1=CC(NC(=O)C2CN(C(=O)C2)C2=CC=C(Br)C=C2)=C(Cl)C=C1
InChIKey
InChIKey=FXTNBIRHWNSWFJ-UHFFFAOYSA-N
Formula
C17H13BrCl2N2O2
Mass
428.11
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
Anilides Dichlorobenzenes Pyrrolidinecarboxamides N-arylamides Bromobenzenes Pyrrolidine-2-ones Aryl chlorides Aryl bromides Tertiary carboxylic acid amides Pyrroles Lactams Secondary carboxylic acid amides Azacyclic compounds Organochlorides Organobromides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Anilide - 1,4-dichlorobenzene - Pyrrolidine carboxylic acid or derivatives - N-arylamide - Pyrrolidine-3-carboxamide - Halobenzene - Bromobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Aryl bromide - Benzenoid - 2-pyrrolidone - Pyrrolidone - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Lactam - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organochloride - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Carbonyl group - 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