Compound Identification
SMILES
CC1=CC=C(C=C1)[C@@H]1N(CC[NH+]2CCOCC2)C(=O)C(=O)C1=C(O)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=VGBBVMVZIQMPMW-NRFANRHFSA-O
Formula
C24H26ClN2O4
Mass
441.93
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Toluenes Chlorobenzenes Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl chlorides N-alkylpyrrolidines Morpholines Vinylogous acids Tertiary carboxylic acid amides Quaternary ammonium salts Pyrroles Trialkylamines Amino acids and derivatives Cyclic ketones Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Enols Organochlorides Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Toluene - Halobenzene - Chlorobenzene - 2-pyrrolidone - 3-pyrrolidone - Pyrrolidone - Aryl chloride - Monocyclic benzene moiety - Morpholine - Benzenoid - Oxazinane - Aryl halide - N-alkylpyrrolidine - Tertiary carboxylic acid amide - Vinylogous acid - Quaternary ammonium salt - Pyrrole - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - Cyclic ketone - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Azacycle - Dialkyl ether - Enol - Oxacycle - Ether - Carbonyl group - Organic oxide - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Amine - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen 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