Compound Identification
SMILES
CCOC(=O)\C=C(\C)N=C1C(CCN1C1=C(Cl)C=C(Cl)C=C1)C(=O)OCC
InChIKey
InChIKey=DJWHMOVHTVKKOJ-VARNCAAHSA-N
Formula
C19H22Cl2N2O4
Mass
413.3
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
Pyrrolidine carboxylic acids Dichlorobenzenes Fatty acid esters Imidolactams Dicarboxylic acids and derivatives Aryl chlorides Pyrroles Enoate esters Propargyl-type 1,3-dipolar organic compounds Carboxamidines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - 1,3-dichlorobenzene - Chlorobenzene - Fatty acid ester - Halobenzene - Fatty acyl - Imidolactam - Dicarboxylic acid or derivatives - Aryl chloride - Benzenoid - Monocyclic benzene moiety - Aryl halide - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Pyrrole - Carboxylic acid ester - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Carbonyl group - Organooxygen compound - Organonitrogen compound - Organohalogen compound - Organochloride - Aromatic heteromonocyclic 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