Compound Identification
SMILES
COC(=O)C1=NN[C@@H]2[C@@H]1C(=O)N(C2=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=NYIAXROHKXAYGX-DTWKUNHWSA-N
Formula
C13H10N4O6
Mass
318.245
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 Nitrobenzenes Pyrrolopyrazoles Nitroaromatic compounds Pyrrolidine-2-ones N-substituted carboxylic acid imides Pyrroles Pyrazolines Dicarboximides Methyl esters Lactams N-alkylated hydrazones Azacyclic compounds Monocarboxylic acids and derivatives Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organic zwitterions Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-phenylpyrrolidine - Alpha-amino acid or derivatives - Nitrobenzene - Nitroaromatic compound - Pyrrolopyrazole - Monocyclic benzene moiety - Carboxylic acid imide, n-substituted - Pyrrolidone - Benzenoid - 2-pyrrolidone - Carboxylic acid imide - Dicarboximide - Pyrazoline - Pyrrole - Methyl ester - Carboxylic acid ester - Lactam - C-nitro compound - Organic nitro compound - N-alkylated hydrazone - Carboxylic acid derivative - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Hydrazone - Azacycle - Monocarboxylic acid or derivatives - Organic salt - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organic zwitterion - 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