Compound Identification
SMILES
CCC1=CC(=O)N(N)C(N\N=C(/CC(=O)OC)C(=O)OC)=N1
InChIKey
InChIKey=QZQZYAJSPLIGRF-OVCLIPMQSA-N
Formula
C12H17N5O5
Mass
311.298
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Diazines
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Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Pyrimidones
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Subclass
Pyrimidines and pyrimidine derivatives
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Class
Diazines
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Pyrimidones
Alternative Parents
Fatty acid methyl esters Hydropyrimidines Dicarboxylic acids and derivatives Methyl esters Heteroaromatic compounds Lactams Hydrazones Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Fatty acid ester - Fatty acid methyl ester - Pyrimidone - Dicarboxylic acid or derivatives - Hydropyrimidine - Fatty acyl - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Lactam - Carboxylic acid derivative - Hydrazone - Azacycle - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrimidones. These are compounds that contain a pyrimidine ring, which bears a ketone. Pyrimidine is a 6-membered ring consisting of four carbon atoms and two nitrogen centers at the 1- and 3- ring positions.
External Descriptors
Not available