Compound Identification
SMILES
OC(=C1[C@H](N(C[C@H](CC([O-])=O)C2=CC=CC=C2)C(=O)C1=O)C1=CC=C(Cl)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=XLOBHOLAVUYTTM-GBXCKJPGSA-M
Formula
C27H21ClNO5
Mass
474.92
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
-
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
Phenylpropanoic acids Chlorobenzenes Aryl chlorides N-alkylpyrrolidines Pyrrolidine-2-ones Pyrrolidine-3-ones Vinylogous acids Tertiary carboxylic acid amides Pyrroles Lactams Cyclic ketones Carboxylic acid salts Azacyclic compounds Monocarboxylic acids and derivatives Enols Carboxylic acids Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Organic anions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
3-phenylpropanoic-acid - 2-phenylpyrrolidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - N-alkylpyrrolidine - 3-pyrrolidone - 2-pyrrolidone - Pyrrolidone - Vinylogous acid - Tertiary carboxylic acid amide - Pyrrole - Carboxamide group - Carboxylic acid salt - Ketone - Lactam - Cyclic ketone - Monocarboxylic acid or derivatives - Azacycle - Enol - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic anion - 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