Compound Identification
SMILES
COC1=CC=C(C=C1)N1C(=O)C[C@@H]([NH2+]CCC2=CC=CS2)C1=O
InChIKey
InChIKey=YCQMLAKJYVEPDK-OAHLLOKOSA-O
Formula
C17H19N2O3S
Mass
331.41
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
Alpha amino acids and derivatives Methoxyanilines Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Aralkylamines N-substituted carboxylic acid imides Pyrrolidine-2-ones Quaternary ammonium salts Thiophenes Heteroaromatic compounds Dicarboximides Pyrroles Lactams Azacyclic compounds Dialkylamines Organic oxides Carbonyl compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Aralkylamine - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrolidone - 2-pyrrolidone - Benzenoid - Quaternary ammonium salt - Thiophene - Pyrrole - Carboxylic acid imide - Heteroaromatic compound - Dicarboximide - Amino acid or derivatives - Lactam - Secondary amine - Azacycle - Carboxylic acid derivative - Ether - Secondary aliphatic amine - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxide - Hydrocarbon derivative - Amine - 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