Compound Identification
SMILES
[Na+].CC1=CC=C(C=C1)N1C(=O)NC(C([O-])=O)=C(C(O)=O)C1=O
InChIKey
InChIKey=REWAUOWETWXVRM-UHFFFAOYSA-M
Formula
C13H9N2NaO6
Mass
312.213
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
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Level 5
Pyrimidinecarboxylic acids and derivatives
- Level 6 Pyrimidinecarboxylic acids
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Level 5
Pyrimidinecarboxylic acids and derivatives
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Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Pyrimidinecarboxylic acids and derivatives
Direct Parent
Pyrimidinecarboxylic acids
Alternative Parents
Hydropyrimidine carboxylic acids and derivatives Toluenes Pyrimidones Vinylogous amides Heteroaromatic compounds Ureas Carboxylic acid salts Lactams Azacyclic compounds Carboxylic acids Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic sodium salts Organonitrogen compounds Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Hydropyrimidine carboxylic acid derivative - Pyrimidine-6-carboxylic acid - Pyrimidine-5-carboxylic acid - Pyrimidone - Toluene - Monocyclic benzene moiety - Hydropyrimidine - Benzenoid - Vinylogous amide - Heteroaromatic compound - Carboxylic acid salt - Lactam - Urea - Azacycle - Organic alkali metal salt - Carboxylic acid - Carboxylic acid derivative - Organooxygen compound - Organonitrogen compound - Organic salt - Organic nitrogen compound - Organic sodium salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidinecarboxylic acids. These are pyrimidines with a structure containing a carboxyl group attached to the pyrimidine ring.
External Descriptors
Not available