Compound Identification
SMILES
COC1=C(C=C(Br)C=C1)C1NC(C)(C2C1C(=O)N(CC1=CC=CC=C1)C2=O)C(O)=O
InChIKey
InChIKey=YBTGOXYXUYNPOA-UHFFFAOYSA-N
Formula
C22H21BrN2O5
Mass
473.323
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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 Anisoles Pyrrolidine carboxylic acids Methoxybenzenes Phenoxy compounds Aralkylamines Bromobenzenes Alkyl aryl ethers Pyrrolidine-2-ones Aryl bromides N-alkylpyrrolidines N-substituted carboxylic acid imides Pyrroles Dicarboximides Lactams Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Alpha-amino acid - Alpha-amino acid or derivatives - Anisole - Phenoxy compound - Phenol ether - Pyrrolidine carboxylic acid - Methoxybenzene - Pyrrolidine carboxylic acid or derivatives - Alkyl aryl ether - Bromobenzene - Halobenzene - Aralkylamine - Pyrrolidone - Aryl bromide - Carboxylic acid imide, n-substituted - Aryl halide - 2-pyrrolidone - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Carboxylic acid imide - Dicarboximide - Pyrrole - Lactam - Amino acid or derivatives - Amino acid - Monocarboxylic acid or derivatives - Ether - Carboxylic acid derivative - Secondary aliphatic amine - Carboxylic acid - Azacycle - Secondary amine - Organic nitrogen compound - Carbonyl group - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen 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