Compound Identification
SMILES
COC(=O)C1=C(N)C([As]C2CCOCC2)=NC(Cl)=N1
InChIKey
InChIKey=UZJHRDPULLEZCZ-UHFFFAOYSA-N
Formula
C11H14AsClN3O3
Mass
346.62
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
-
Level 5
Pyrimidinecarboxylic acids and derivatives
- Level 6 Pyrimidinecarboxylic acids
-
Level 5
Pyrimidinecarboxylic acids and derivatives
-
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
2-halopyrimidines Aminopyrimidines and derivatives Oxanes Aryl chlorides Vinylogous amides Heteroaromatic compounds Methyl esters Amino acids and derivatives Oxygen-containing organoarsenic compounds Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organic metalloid salts Organochlorides Organic oxides Hydrocarbon derivatives Primary amines
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Pyrimidine-6-carboxylic acid - Aminopyrimidine - 2-halopyrimidine - Halopyrimidine - Aryl chloride - Aryl halide - Oxane - Heteroaromatic compound - Vinylogous amide - Methyl ester - Amino acid or derivatives - Carboxylic acid ester - Oxygen-containing organoarsenic compound - Carboxylic acid derivative - Dialkyl ether - Ether - Oxacycle - Azacycle - Organic metalloid salt - Organic metalloid moeity - Organohalogen compound - Organic oxide - Organic oxygen compound - Hydrocarbon derivative - Organoarsenic compound - Organochloride - Organonitrogen compound - Organooxygen compound - Amine - Primary amine - Organic nitrogen compound - 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