Compound Identification
SMILES
CCOC1=CC=C(C=C1)C1N(CCCN2C=CN=C2)C(=O)C(=O)C1=C(O)C1=CC(Cl)=C(OC)C=C1
InChIKey
InChIKey=ATWDMNFTPSEBRN-UHFFFAOYSA-N
Formula
C26H26ClN3O5
Mass
495.96
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
Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Chlorobenzenes Aryl chlorides Pyrrolidine-3-ones Pyrrolidine-2-ones N-alkylpyrrolidines N-substituted imidazoles Vinylogous acids Heteroaromatic compounds Tertiary carboxylic acid amides Pyrroles Lactams Cyclic ketones Azacyclic compounds Enols Hydrocarbon derivatives Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Halobenzene - Chlorobenzene - N-substituted imidazole - Aryl chloride - Aryl halide - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Monocyclic benzene moiety - N-alkylpyrrolidine - Azole - Tertiary carboxylic acid amide - Pyrrole - Imidazole - Heteroaromatic compound - Vinylogous acid - Cyclic ketone - Carboxamide group - Ketone - Lactam - Ether - Enol - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organochloride - Organic oxide - Organohalogen compound - 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