Compound Identification
SMILES
COC(=O)[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)N(C(=O)[C@H]13)C1=CC=C(Cl)C=C1
InChIKey
InChIKey=JMGZTLGAWKHNIA-IFVOIRTQSA-N
Formula
C16H16ClNO3
Mass
305.76
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
Aromatic monoterpenoids Caprolactams Azepanes Chlorobenzenes Pyrrolidine-2-ones Aryl chlorides Tertiary carboxylic acid amides Pyrroles Methyl esters Azacyclic compounds Monocarboxylic acids and derivatives Organic oxides Carbonyl compounds Organochlorides Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Monoterpenoid - Aromatic monoterpenoid - Norbornane monoterpenoid - Caprolactam - Chlorobenzene - Halobenzene - Azepane - Monocyclic benzene moiety - Benzenoid - 2-pyrrolidone - Pyrrolidone - Aryl halide - Aryl chloride - Methyl ester - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Organochloride - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organohalogen 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