Compound Identification
SMILES
CC1=CC=CC=C1N1C[C@@H](CC1=O)C1=NC2=CC=CC=C2N1CCOC1=CC=C(Cl)C=C1
InChIKey
InChIKey=XPPQFZAOPVXNOK-LJQANCHMSA-N
Formula
C26H24ClN3O2
Mass
445.95
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
Benzimidazoles Phenoxy compounds Phenol ethers Toluenes Alkyl aryl ethers Chlorobenzenes Aryl chlorides Pyrrolidine-2-ones N-substituted imidazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Tertiary amines Amino acids and derivatives Lactams Azacyclic compounds Organochlorides Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Benzimidazole - Phenoxy compound - Phenol ether - Alkyl aryl ether - Chlorobenzene - Halobenzene - Toluene - Aryl chloride - N-substituted imidazole - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Benzenoid - Heteroaromatic compound - Azole - Pyrrole - Imidazole - Tertiary carboxylic acid amide - Carboxamide group - Lactam - Tertiary amine - Amino acid or derivatives - Carboxylic acid derivative - Ether - Azacycle - Organic nitrogen compound - Organohalogen compound - Carbonyl group - Organochloride - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - 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