Compound Identification
SMILES
COC1=CC=C(C=C1)C(O)=C1[C@H](N(CCC[NH+](C)C)C(=O)C1=O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=JRGKTUKHXNSBGM-HXUWFJFHSA-O
Formula
C23H26ClN2O4
Mass
429.92
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 N-alkylpyrrolidines Pyrrolidine-3-ones Pyrrolidine-2-ones Quaternary ammonium salts Tertiary carboxylic acid amides Pyrroles Vinylogous acids Amino acids and derivatives Lactams Cyclic ketones Trialkylamines Enols Azacyclic compounds Organic oxides Hydrocarbon derivatives Organochlorides Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Quaternary ammonium salt - Amino acid or derivatives - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Carboxamide group - Ketone - Lactam - Azacycle - Carboxylic acid derivative - Enol - Ether - Organic oxide - Organochloride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organohalogen compound - Organic cation - 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