Compound Identification
SMILES
[Na+].[O-]C(=O)C1=CC=CN(CC2=CC=CC=C2Br)C1=O
InChIKey
InChIKey=QDZMKHPSNBFXLZ-UHFFFAOYSA-M
Formula
C13H9BrNNaO3
Mass
330.113
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyridines and derivatives
-
Subclass
Pyridinecarboxylic acids and derivatives
- Level 5 Pyridinecarboxylic acids
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Subclass
Pyridinecarboxylic acids and derivatives
-
Class
Pyridines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyridines and derivatives
Subclass
Pyridinecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyridinecarboxylic acids
Alternative Parents
Dihydropyridinecarboxylic acids and derivatives Pyridinones Bromobenzenes Aryl bromides Vinylogous amides Heteroaromatic compounds Carboxylic acid salts Lactams Azacyclic compounds Carboxylic acids Organic metal halides Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Organobromides Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Dihydropyridinecarboxylic acid derivative - Pyridine carboxylic acid - Bromobenzene - Dihydropyridine - Halobenzene - Pyridinone - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Hydropyridine - Benzenoid - Heteroaromatic compound - Vinylogous amide - Carboxylic acid salt - Lactam - Organic metal halide - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic alkali metal salt - Organic salt - Organic sodium salt - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyridinecarboxylic acids. These are compounds containing a pyridine ring bearing a carboxylic acid group.
External Descriptors
Not available