Compound Identification
SMILES
CCC1=CC=CC(CC)=C1N1C(=O)C2C(NC(C2C1=O)(C(O)=O)C1=CC=CC=C1)C1=C(O)C=CC(Br)=C1
InChIKey
InChIKey=OGEMJTKCRMYBCL-UHFFFAOYSA-N
Formula
C29H27BrN2O5
Mass
563.448
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
Alpha amino acids Pyrrolidine carboxylic acids P-bromophenols 1-hydroxy-2-unsubstituted benzenoids Aralkylamines Bromobenzenes Pyrrolidine-2-ones N-substituted carboxylic acid imides Aryl bromides Pyrroles Dicarboximides Amino acids Lactams Monocarboxylic acids and derivatives Dialkylamines Azacyclic compounds Carboxylic acids Organic oxides Organobromides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - 2-phenylpyrrolidine - Alpha-amino acid - Alpha-amino acid or derivatives - 4-halophenol - 4-bromophenol - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Bromobenzene - Phenol - Aralkylamine - Aryl halide - Aryl bromide - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - Monocyclic benzene moiety - Benzenoid - Pyrrole - Carboxylic acid imide - Dicarboximide - Amino acid - Lactam - Amino acid or derivatives - Azacycle - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Amine - Carbonyl group - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organic oxide - Organobromide - Organohalogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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