Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(=O)CC(N(CC2=CC3=C(OCO3)C=C2)C(=O)C=CC(O)=O)C1=O
InChIKey
InChIKey=IKWUBHCKOPSDEL-UHFFFAOYSA-N
Formula
C23H20N2O8
Mass
452.419
Taxonomic Classification
Taxonomy Tree
-
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
Alpha amino acids and derivatives Benzodioxoles Methoxyanilines Anisoles Phenoxy compounds Methoxybenzenes Alkyl aryl ethers Pyrrolidine-2-ones N-acyl amines N-substituted carboxylic acid imides Pyrroles Tertiary carboxylic acid amides Dicarboximides Lactams Monocarboxylic acids and derivatives Oxacyclic compounds Azacyclic compounds Carboxylic acids Acetals Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Methoxyaniline - Benzodioxole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - N-acyl-amine - Benzenoid - 2-pyrrolidone - Pyrrolidone - Carboxylic acid imide, n-substituted - Monocyclic benzene moiety - Dicarboximide - Tertiary carboxylic acid amide - Pyrrole - Carboxylic acid imide - Lactam - Carboxamide group - Acetal - Oxacycle - Carboxylic acid derivative - Azacycle - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organopnictogen compound - Organooxygen compound - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - 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