Compound Identification
SMILES
CC(=O)NCCN1C(\C(=C(/O)C2=CC=C(Cl)C=C2)C(=O)C1=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=UELKQDQTMCRGHS-HTXNQAPBSA-N
Formula
C21H18ClN3O6
Mass
443.84
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
Nitrobenzenes Nitroaromatic compounds Chlorobenzenes Pyrrolidine-3-ones Pyrrolidine-2-ones Aryl chlorides N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Pyrroles Acetamides Secondary carboxylic acid amides Cyclic ketones Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Enols Organic oxoazanium compounds Organonitrogen compounds Organic zwitterions Hydrocarbon derivatives Organic salts Organochlorides Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Nitrobenzene - Nitroaromatic compound - Halobenzene - Chlorobenzene - N-alkylpyrrolidine - 3-pyrrolidone - Benzenoid - 2-pyrrolidone - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Pyrrolidone - Vinylogous acid - Acetamide - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Lactam - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Cyclic ketone - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Enol - Azacycle - Organic oxoazanium - Organic oxygen compound - Organic nitrogen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organohalogen compound - Organic salt - Organochloride - Organonitrogen compound - Organooxygen compound - 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