Compound Identification
SMILES
CC1=C(C=CC=C1Cl)N1CC(CC1=O)C(=O)NC1=CC=C(C=C1)C#N
InChIKey
InChIKey=AKHMNMOMPXRKMO-UHFFFAOYSA-N
Formula
C19H16ClN3O2
Mass
353.81
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
Anilides Pyrrolidinecarboxamides Benzonitriles N-arylamides Toluenes Chlorobenzenes Pyrrolidine-2-ones Aryl chlorides Tertiary carboxylic acid amides Pyrroles Secondary carboxylic acid amides Lactams Azacyclic compounds Nitriles Organic oxides Organochlorides Carbonyl compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Anilide - Benzonitrile - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-3-carboxamide - N-arylamide - Chlorobenzene - Halobenzene - Toluene - Aryl halide - 2-pyrrolidone - Pyrrolidone - Benzenoid - Monocyclic benzene moiety - Aryl chloride - Tertiary carboxylic acid amide - Pyrrole - Secondary carboxylic acid amide - Carboxamide group - Lactam - Azacycle - Carboxylic acid derivative - Nitrile - Carbonitrile - Organic oxide - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Cyanide - 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