Compound Identification
SMILES
COC1=CC=CC=C1N1C[C@@H](CC1=O)C(=O)OCC(=O)C1=CC=C(C)S1
InChIKey
InChIKey=SBRRMMKRBFOAGF-CYBMUJFWSA-N
Formula
C19H19NO5S
Mass
373.42
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
Methoxyanilines Anisoles Aryl alkyl ketones Methoxybenzenes Oxoprolines Phenoxy compounds Pyrrolidine carboxylic acids Alpha-acyloxy ketones 2,5-disubstituted thiophenes Alkyl aryl ethers Pyrrolidine-2-ones Tertiary carboxylic acid amides Heteroaromatic compounds Pyrroles Lactams Carboxylic acid esters Monocarboxylic acids and derivatives Azacyclic compounds Organic oxides Hydrocarbon derivatives Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Methoxyaniline - Anisole - Phenoxy compound - Oxoproline - Phenol ether - Pyrrolidine carboxylic acid - Pyrrolidine carboxylic acid or derivatives - Methoxybenzene - Aryl ketone - Aryl alkyl ketone - Alkyl aryl ether - 2,5-disubstituted thiophene - Alpha-acyloxy ketone - 2-pyrrolidone - Pyrrolidone - Benzenoid - Monocyclic benzene moiety - Thiophene - Tertiary carboxylic acid amide - Heteroaromatic compound - Pyrrole - Carboxamide group - Carboxylic acid ester - Ketone - Lactam - Azacycle - Carboxylic acid derivative - Ether - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic oxide - Carbonyl group - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - 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