Compound Identification
SMILES
CCOC(=O)\C=C/[C@@H]1[C@@H]2OC(C)(C)O[C@@H]2[C@H](N1C(=O)OC(C)(C)C)C1=CC=CC=C1
InChIKey
InChIKey=JHIYEBUDUVQJIB-QAKNLIBKSA-N
Formula
C23H31NO6
Mass
417.502
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
Pyrrolidine carboxylic acids Ketals Fatty acid esters Benzene and substituted derivatives Pyrroles 1,3-dioxolanes Carbamate esters Enoate esters Oxacyclic compounds Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Fatty acid ester - Ketal - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Meta-dioxolane - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Carbamic acid ester - Pyrrole - Carboxylic acid ester - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organic nitrogen compound - Organopnictogen compound - Organic oxygen 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