Compound Identification
SMILES
COC1=C(C=C(Br)C=C1)C1NC(CCCCN)(C2C1C(=O)N(C1CCCCC1)C2=O)C(O)=O
InChIKey
InChIKey=WAEMNBFJEMUHMP-UHFFFAOYSA-N
Formula
C24H32BrN3O5
Mass
522.44
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 Pyrrolidine carboxylic acids Phenoxy compounds Anisoles Medium-chain fatty acids Methoxybenzenes Alkyl aryl ethers Aralkylamines Bromobenzenes Halogenated fatty acids Heterocyclic fatty acids Pyrrolidine-2-ones Aryl bromides N-substituted carboxylic acid imides N-alkylpyrrolidines Dicarboximides Pyrroles Amino acids Lactams Dialkylamines Carboxylic acids Azacyclic compounds Monocarboxylic acids and derivatives Organopnictogen compounds Carbonyl compounds Organic oxides Organobromides Hydrocarbon derivatives Monoalkylamines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Alpha-amino acid - Alpha-amino acid or derivatives - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Medium-chain fatty acid - Alkyl aryl ether - Heterocyclic fatty acid - Halogenated fatty acid - Halobenzene - Aralkylamine - Bromobenzene - 2-pyrrolidone - Pyrrolidone - N-alkylpyrrolidine - Benzenoid - Fatty acid - Fatty acyl - Monocyclic benzene moiety - Aryl halide - Aryl bromide - Carboxylic acid imide, n-substituted - Carboxylic acid imide - Dicarboximide - Pyrrole - Amino acid or derivatives - Lactam - Amino acid - Monocarboxylic acid or derivatives - Azacycle - Secondary amine - Ether - Carboxylic acid derivative - Secondary aliphatic amine - Carboxylic acid - Organobromide - Organic nitrogen compound - Organic oxygen compound - Carbonyl group - Organopnictogen compound - Primary amine - Hydrocarbon derivative - Organooxygen compound - Organic oxide - Primary aliphatic amine - Amine - Organonitrogen compound - 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