Compound Identification
SMILES
COC(=O)C1=CC=C(C=C1)C1N(C(=O)C(=O)C1=C(O)C1=CC2=C(OCCO2)C=C1)C1=NC=CS1
InChIKey
InChIKey=INFAYCORMQGNAC-UHFFFAOYSA-N
Formula
C24H18N2O7S
Mass
478.48
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
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
Benzo-1,4-dioxanes Benzoic acid esters Benzoyl derivatives Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Para dioxins Vinylogous acids Thiazoles Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Methyl esters Lactams Cyclic ketones Azacyclic compounds Enols Oxacyclic compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzo-1,4-dioxane - Benzoate ester - Benzodioxane - Benzoic acid or derivatives - Benzoyl - Alkyl aryl ether - Para-dioxin - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Azole - Tertiary carboxylic acid amide - Thiazole - Methyl ester - Heteroaromatic compound - Pyrrole - Vinylogous acid - Cyclic ketone - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Carboxylic acid derivative - Azacycle - Oxacycle - Enol - Ether - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - 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