Compound Identification
SMILES
OC(=O)CCCN1[C@H](\C(=C(/O)C2=CC=C(C=C2)[N+]([O-])=O)C(=O)C1=O)C1=CC(=CC=C1)[N+]([O-])=O
InChIKey
InChIKey=QLRIWIGLCAZKTN-GHNGSUTGSA-N
Formula
C21H17N3O9
Mass
455.379
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
Nitrobenzenes Nitroaromatic compounds N-alkylpyrrolidines Pyrrolidine-2-ones Pyrrolidine-3-ones Pyrroles Tertiary carboxylic acid amides Vinylogous acids Amino acids Cyclic ketones Lactams Tertiary amines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Carboxylic acids Enols Monocarboxylic acids and derivatives Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Nitrobenzene - Nitroaromatic compound - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Ketone - Lactam - C-nitro compound - Amino acid - Organic nitro compound - Tertiary amine - Cyclic ketone - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Enol - Organic 1,3-dipolar compound - Carboxylic acid - Organic oxoazanium - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organic salt - Organooxygen compound - Organic oxide - Organic zwitterion - Amine - 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