Compound Identification
SMILES
COCCCN1C(\C(=C(/O)C2=CC3=C(OCCO3)C=C2)C(=O)C1=O)C1=CC=C(C=C1)C(=O)OC
InChIKey
InChIKey=BGEZUTGISTYHNM-LSDHQDQOSA-N
Formula
C25H25NO8
Mass
467.474
Taxonomic Classification
Taxonomy Tree
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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
Benzo-1,4-dioxanes Benzoic acid esters Benzoyl derivatives Alkyl aryl ethers Pyrrolidine-3-ones Pyrrolidine-2-ones Para dioxins N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Pyrroles Methyl esters Cyclic ketones Lactams Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Dialkyl ethers Enols Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzo-1,4-dioxane - Benzodioxane - Benzoate ester - Benzoic acid or derivatives - Benzoyl - Alkyl aryl ether - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - Benzenoid - Para-dioxin - N-alkylpyrrolidine - Pyrrole - Tertiary carboxylic acid amide - Methyl ester - Vinylogous acid - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Cyclic ketone - Ether - Enol - Dialkyl ether - Carboxylic acid derivative - Azacycle - Oxacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organopnictogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - 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