Compound Identification
SMILES
CN(C)CCN1C(C(=C(O)C2=CC3=C(OCCO3)C=C2)C(=O)C1=O)C1=CC=C(Br)C=C1
InChIKey
InChIKey=RUUGEAPVNATYJW-UHFFFAOYSA-N
Formula
C23H23BrN2O5
Mass
487.35
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
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Benzo-1,4-dioxanes Alkyl aryl ethers Bromobenzenes Aryl bromides N-alkylpyrrolidines Para dioxins Pyrrolidine-2-ones Pyrrolidine-3-ones Tertiary carboxylic acid amides Vinylogous acids Pyrroles Amino acids and derivatives Lactams Cyclic ketones Trialkylamines Enols Oxacyclic compounds Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzodioxane - Benzo-1,4-dioxane - Alkyl aryl ether - Halobenzene - Bromobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Para-dioxin - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Pyrrole - Tertiary carboxylic acid amide - Vinylogous acid - Amino acid or derivatives - Ketone - Lactam - Tertiary amine - Tertiary aliphatic amine - Carboxamide group - Cyclic ketone - Azacycle - Ether - Enol - Oxacycle - Carboxylic acid derivative - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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