Compound Identification
SMILES
[K+].[K+].COC1=CC=C(C=C2C(=O)N(CCC([O-])=O)C(=O)N(CCC([O-])=O)C2=O)C=C1
InChIKey
InChIKey=COOFXWWDQOQMDO-UHFFFAOYSA-L
Formula
C18H16K2N2O8
Mass
466.529
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Level 5
Pyrimidones
- Level 6 Barbituric acid derivatives
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Level 5
Pyrimidones
-
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
Pyrimidones
Direct Parent
Barbituric acid derivatives
Alternative Parents
Phenoxy compounds Anisoles Methoxybenzenes Alkyl aryl ethers N-acyl ureas Diazinanes Dicarboxylic acids and derivatives Dicarboximides Carboxylic acid salts Carboxylic acids Azacyclic compounds Organic oxides Organic potassium salts Organopnictogen compounds Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Barbiturate - Phenoxy compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - N-acyl urea - Ureide - Monocyclic benzene moiety - 1,3-diazinane - Dicarboxylic acid or derivatives - Benzenoid - Dicarboximide - Carboxylic acid salt - Urea - Carbonic acid derivative - Carboxylic acid derivative - Carboxylic acid - Azacycle - Organic alkali metal salt - Ether - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Organic potassium salt - Organic oxide - Organic salt - Organooxygen compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as barbituric acid derivatives. These are compounds containing a perhydropyrimidine ring substituted at C-2, -4 and -6 by oxo groups.
External Descriptors
Not available