Compound Identification
SMILES
CCOC(=O)C1=NN(C2C1C(=O)N(C2=O)C1=CC=C(Br)C=C1)C1=CC=C(C)C=C1
InChIKey
InChIKey=BSFVOERALJXLNR-UHFFFAOYSA-N
Formula
C21H18BrN3O4
Mass
456.296
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
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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 and derivatives Pyrrolopyrazoles Toluenes Bromobenzenes Pyrrolidine-2-ones Aryl bromides N-substituted carboxylic acid imides Pyrroles Pyrazolines Dicarboximides N-alkylated hydrazones Lactams Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Pyrrolopyrazole - Halobenzene - Toluene - Bromobenzene - Carboxylic acid imide, n-substituted - Aryl halide - 2-pyrrolidone - Pyrrolidone - Aryl bromide - Benzenoid - Monocyclic benzene moiety - Carboxylic acid imide - Pyrrole - Pyrazoline - Dicarboximide - Carboxylic acid ester - N-alkylated hydrazone - Lactam - Hydrazone - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organobromide - Organohalogen compound - 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