Compound Identification
SMILES
CC(=O)N1C[C@@H]2[C@@H]3O[C@@H](C=C3)[C@@H]2[C@H]1CC#N
InChIKey
InChIKey=VUIAAELDXTWFIF-JCIQBVFBSA-N
Formula
C12H14N2O2
Mass
218.256
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Isoindoles and derivatives
- Subclass Isoindolines
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Class
Isoindoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoindoles and derivatives
Subclass
Isoindolines
Intermediate Tree Nodes
Not available
Direct Parent
Isoindolines
Alternative Parents
N-acylpyrrolidines Tertiary carboxylic acid amides Oxolanes Dihydrofurans Acetamides Oxacyclic compounds Nitriles Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Isoindoline - N-acylpyrrolidine - Dihydrofuran - Oxolane - Pyrrolidine - Tertiary carboxylic acid amide - Acetamide - Carboxamide group - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonitrile - Nitrile - Oxacycle - Azacycle - Organic oxide - Cyanide - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - 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