Compound Identification
SMILES
OC(=O)C1=C(Br)C=C(C=C1)C1NCC(C1Br)(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)C(F)(F)F
InChIKey
InChIKey=NUIFODGYCGRVPE-UHFFFAOYSA-N
Formula
C20H12Br2F9NO2
Mass
629.115
Taxonomic Classification
Taxonomy Tree
-
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
Trifluoromethylbenzenes 2-halobenzoic acids Halobenzoic acids Benzoic acids 1-carboxy-2-haloaromatic compounds Benzoyl derivatives Aralkylamines Bromobenzenes Aryl bromides Pyrroles Vinylogous halides Amino acids Dialkylamines Azacyclic compounds Organobromides Organofluorides Organooxygen compounds Alkyl fluorides Alkyl bromides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - 3-phenylpyrrolidine - Trifluoromethylbenzene - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - 2-halobenzoic acid - Halobenzoic acid - Benzoic acid or derivatives - Benzoic acid - Benzoyl - 1-carboxy-2-haloaromatic compound - Aralkylamine - Bromobenzene - Halobenzene - Benzenoid - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrrole - Vinylogous halide - Amino acid or derivatives - Amino acid - Secondary amine - Azacycle - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Alkyl fluoride - Alkyl bromide - Amine - Alkyl halide - Organonitrogen compound - Organic oxygen compound - Organooxygen compound - Organofluoride - Organohalogen compound - Organobromide - 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