Compound Identification
SMILES
CCC(C)(C)C(=O)C(=O)[N+]1(CC)CCCC1(C([O-])=S)C1=CC=CC=C1
InChIKey
InChIKey=ZFAFSFMHGNAZJZ-UHFFFAOYSA-N
Formula
C20H27NO3S
Mass
361.5
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
N-acylpyrrolidines Benzene and substituted derivatives N-alkylpyrrolidines Quaternary ammonium salts Pyrroles Ketones Carbothioic O-acids Carbodithioic acids Azacyclic compounds Carboxylic acids and derivatives Thiocarboxylic acids Organic oxides Thiocarbonyl compounds Hydrocarbon derivatives Organic salts Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - N-acylpyrrolidine - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Pyrrole - Quaternary ammonium salt - Carbodithioic acid - Carbothioic o-acid - Ketone - Azacycle - Thiocarboxylic acid - Carboxylic acid derivative - Organic salt - Hydrocarbon derivative - Organic oxide - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Thiocarbonyl group - Carbonyl group - 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