Compound Identification
SMILES
COC1=CC=C(C=C1)C(\O)=C1/C(N(CCCO)C(=O)C1=O)C1=CC=C(C=C1)[N+]([O-])=O
InChIKey
InChIKey=ADKGFSPSPGCMKQ-ZPHPHTNESA-N
Formula
C21H20N2O7
Mass
412.398
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 Methoxybenzenes Nitroaromatic compounds Anisoles Phenoxy compounds Alkyl aryl ethers N-alkylpyrrolidines Pyrrolidine-3-ones Pyrrolidine-2-ones Tertiary carboxylic acid amides Vinylogous acids Pyrroles Lactams Cyclic ketones Organic oxoazanium compounds Azacyclic compounds Enols Propargyl-type 1,3-dipolar organic compounds Alkanolamines Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Primary alcohols
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-phenylpyrrolidine - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - N-alkylpyrrolidine - Benzenoid - 3-pyrrolidone - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Pyrrole - Vinylogous acid - Tertiary carboxylic acid amide - Carboxamide group - Ketone - Lactam - C-nitro compound - Organic nitro compound - Cyclic ketone - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Carboxylic acid derivative - Enol - Ether - Alkanolamine - Organic oxoazanium - Azacycle - Carbonyl group - Organic salt - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Alcohol - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Primary alcohol - 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