Compound Identification
SMILES
COC1=CC=C(C=C1)C1N(CCBr)C(=O)C(=O)C1=C(O)C1=CC=CC=C1
InChIKey
InChIKey=BRSSUPSDHBPOFY-UHFFFAOYSA-N
Formula
C20H18BrNO4
Mass
416.271
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Pyrrolidine-3-ones N-alkylpyrrolidines Pyrrolidine-2-ones Vinylogous acids Tertiary carboxylic acid amides Pyrroles Lactams Cyclic ketones Enols Azacyclic compounds Organobromides Organic oxides Alkyl bromides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Vinylogous acid - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Lactam - Cyclic ketone - Ether - Enol - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organobromide - Organohalogen compound - Alkyl halide - Alkyl bromide - Organic nitrogen compound - Carbonyl group - Organic oxide - Organooxygen compound - Hydrocarbon derivative - Organic oxygen 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