Compound Identification
SMILES
[Na+].CC([CH-]C(=O)C1=NC=CC2=CC=CC=C12)C#N
InChIKey
InChIKey=LHKNEAULDFWDDY-UHFFFAOYSA-N
Formula
C14H11N2NaO
Mass
246.245
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Isoquinolines and derivatives
Alternative Parents
Aryl ketones Pyridines and derivatives Benzenoids Heteroaromatic compounds Nitriles Enolates Azacyclic compounds Organic zwitterions Organic sodium salts Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Isoquinoline - Aryl ketone - Pyridine - Benzenoid - Heteroaromatic compound - Ketone - Enolate - Azacycle - Organic alkali metal salt - Carbonitrile - Nitrile - Hydrocarbon derivative - Cyanide - Organic zwitterion - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic salt - Organic sodium salt - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as isoquinolines and derivatives. These are aromatic polycyclic compounds containing an isoquinoline moiety, which consists of a benzene ring fused to a pyridine ring and forming benzo[c]pyridine.
External Descriptors
Not available