Compound Identification
SMILES
CC1=CC=C(C=C1)C(O)=C1C(N(CC(O)=O)C(=O)C1=O)C1=CC=C(Br)C=C1
InChIKey
InChIKey=AYMSUMUQCZJURE-UHFFFAOYSA-N
Formula
C20H16BrNO5
Mass
430.254
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
Alpha amino acids and derivatives Toluenes Bromobenzenes Aryl bromides N-alkylpyrrolidines Pyrrolidine-2-ones Pyrrolidine-3-ones Vinylogous acids Pyrroles Tertiary carboxylic acid amides Lactams Cyclic ketones Monocarboxylic acids and derivatives Enols Carboxylic acids Azacyclic compounds Organobromides Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Alpha-amino acid or derivatives - Halobenzene - Toluene - Bromobenzene - Benzenoid - N-alkylpyrrolidine - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Aryl bromide - Monocyclic benzene moiety - Aryl halide - Vinylogous acid - Tertiary carboxylic acid amide - Pyrrole - Cyclic ketone - Ketone - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Carboxylic acid - Enol - Monocarboxylic acid or derivatives - Organic oxygen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organobromide - Organohalogen 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