Compound Identification
SMILES
OC(=C1C(N(CC2=CN=CC=C2)C(=O)C1=O)C1=CC=C(I)C=C1)C1=CC2=C(OCCO2)C=C1
InChIKey
InChIKey=RTBKBIVACUZHRQ-UHFFFAOYSA-N
Formula
C25H19IN2O5
Mass
554.34
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Benzo-1,4-dioxanes Alkyl aryl ethers Iodobenzenes Pyrrolidine-3-ones Pyrrolidine-2-ones Pyridines and derivatives Para dioxins Aryl iodides N-alkylpyrrolidines Vinylogous acids Tertiary carboxylic acid amides Pyrroles Heteroaromatic compounds Cyclic ketones Lactams Oxacyclic compounds Azacyclic compounds Enols Organoiodides Organonitrogen compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-phenylpyrrolidine - Benzo-1,4-dioxane - Benzodioxane - Alkyl aryl ether - Halobenzene - Iodobenzene - Aryl halide - Aryl iodide - Monocyclic benzene moiety - Para-dioxin - Pyridine - Pyrrolidone - 2-pyrrolidone - 3-pyrrolidone - N-alkylpyrrolidine - Benzenoid - Pyrrole - Heteroaromatic compound - Vinylogous acid - Tertiary carboxylic acid amide - Cyclic ketone - Carboxamide group - Lactam - Ketone - Oxacycle - Azacycle - Carboxylic acid derivative - Enol - Ether - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organopnictogen compound - Carbonyl group - Hydrocarbon derivative - Organohalogen compound - Organoiodide - Organonitrogen compound - Organooxygen compound - 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