Compound Identification
SMILES
CC1=C(NC(=O)C2CN(C(=O)C2)C2=CC=C(Br)C=C2)C=CC(I)=C1
InChIKey
InChIKey=QKCONRFKOJJXPI-UHFFFAOYSA-N
Formula
C18H16BrIN2O2
Mass
499.146
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
Anilides Pyrrolidinecarboxamides N-arylamides Toluenes Iodobenzenes Bromobenzenes Pyrrolidine-2-ones Aryl bromides Aryl iodides Tertiary carboxylic acid amides Pyrroles Secondary carboxylic acid amides Lactams Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organoiodides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Anilide - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-3-carboxamide - N-arylamide - Bromobenzene - Halobenzene - Iodobenzene - Toluene - Aryl iodide - 2-pyrrolidone - Pyrrolidone - Benzenoid - Monocyclic benzene moiety - Aryl bromide - Aryl halide - Tertiary carboxylic acid amide - Pyrrole - Secondary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Organopnictogen compound - Organohalogen compound - Organobromide - Organoiodide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organic oxygen 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