Compound Identification
SMILES
CCOC(=O)C1=C2C(N(N1)C1=CC=C(Br)C=C1)C(=O)N(C2=O)C1=CC=CC=C1OC
InChIKey
InChIKey=JWSCQLDARQLROM-UHFFFAOYSA-N
Formula
C21H18BrN3O5
Mass
472.295
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 and derivatives Methoxyanilines Anisoles Pyrrolopyrazoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Bromobenzenes Pyrrolidine-2-ones N-substituted carboxylic acid imides Aryl bromides Pyrroles Pyrazolines Vinylogous amides Dicarboximides Enoate esters Lactams Azacyclic compounds Monocarboxylic acids and derivatives Alkylhydrazines Carbonyl compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Pyrrolopyrazole - Alkyl aryl ether - Halobenzene - Bromobenzene - Carboxylic acid imide, n-substituted - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Benzenoid - Pyrazoline - Pyrrole - Dicarboximide - Carboxylic acid imide - Vinylogous amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Lactam - Ether - Carboxylic acid derivative - Azacycle - Alkylhydrazine - Monocarboxylic acid or derivatives - Hydrazine derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - 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