Compound Identification
SMILES
[Na+].[O-]C(=O)CC1=C(I)C(N2CCCC2=O)=C(I)C=C1I
InChIKey
InChIKey=RTMQRPQZEVBQRD-UHFFFAOYSA-M
Formula
C12H9I3NNaO3
Mass
618.911
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
4-halophenylacetic acids Iodobenzenes Pyrrolidine-2-ones Aryl iodides Tertiary carboxylic acid amides Pyrroles Carboxylic acid salts Lactams Azacyclic compounds Carboxylic acids Monocarboxylic acids and derivatives Organic metal halides Hydrocarbon derivatives Organonitrogen compounds Organoiodides Organic sodium salts Organic oxides Organopnictogen compounds Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-halophenylacetic acid - 1-phenylpyrrolidine - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Benzenoid - 2-pyrrolidone - Pyrrolidone - Pyrrole - Tertiary carboxylic acid amide - Carboxamide group - Carboxylic acid salt - Lactam - Organic metal halide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic alkali metal salt - Monocarboxylic acid or derivatives - Carbonyl group - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic oxide - Organic nitrogen compound - Organohalogen compound - Organoiodide - Organonitrogen compound - Organooxygen compound - Organic sodium salt - Organic salt - 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