Compound Identification
SMILES
CCOC(=O)C1=NN([C@H]2[C@@H]1C(=O)N(C2=O)C1=CC=C(Br)C=C1)C(C)=O
InChIKey
InChIKey=VKYJUMVBVMBKBV-YPMHNXCESA-N
Formula
C16H14BrN3O5
Mass
408.208
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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 Pyrrolopyrazoles Bromobenzenes Pyrrolidine-2-ones N-substituted carboxylic acid imides Aryl bromides Pyrroles Pyrazolines Acetamides Dicarboximides N-alkylated hydrazones Carboxylic acid esters Lactams Monocarboxylic acids and derivatives Azacyclic compounds Carbonyl compounds Organic oxides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Pyrrolopyrazole - Halobenzene - Bromobenzene - Benzenoid - Aryl halide - 2-pyrrolidone - Pyrrolidone - Aryl bromide - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Acetamide - Carboxylic acid imide - Pyrrole - Pyrazoline - Dicarboximide - Carboxylic acid ester - N-alkylated hydrazone - Lactam - 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