Structure Information
Structure

Compound Identification

SMILES

[I-].CC12CCC(O1)C1C[N+](C)(CCC#N)CC21

InChIKey

InChIKey=CWYJQARFAZVYRK-UHFFFAOYSA-M

Formula

C13H21IN2O

Mass

348.228

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Isoindoles and derivatives

Subclass

Isoindolines

Intermediate Tree Nodes

Not available

Direct Parent

Isoindolines

Alternative Parents

N-alkylpyrrolidines Tetraalkylammonium salts Oxolanes Oxacyclic compounds Nitriles Dialkyl ethers Azacyclic compounds Organic iodide salts Hydrocarbon derivatives Amines Organic cations

Molecular Framework

Aliphatic heteropolycyclic compounds

Substituents

Isoindoline - N-alkylpyrrolidine - Oxolane - Pyrrolidine - Tetraalkylammonium salt - Quaternary ammonium salt - Dialkyl ether - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Cyanide - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic nitrogen compound - Organic salt - Organic iodide salt - Organic cation - Aliphatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as isoindolines. These are heterocyclic compounds containing a 2,3-dihydro-1H-iso-indole moiety.

External Descriptors

Not available

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