Structure Information
Structure

Compound Identification

SMILES

CC(C)(C)C(=O)OCOP(=O)(C\C=C/CN1C=C(Cl)C(=O)NC1=O)OCOC(=O)C(C)(C)C

InChIKey

InChIKey=SQOLTWBUVKVYFZ-FPLPWBNLSA-N

Formula

C20H30ClN2O9P

Mass

508.89

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Diazines

Subclass

Pyrimidines and pyrimidine derivatives

Intermediate Tree Nodes

Not available

Direct Parent

Halopyrimidines

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Dialkyl alkylphosphonate - Halopyrimidine - Phosphonic acid diester - Pyrimidone - Aryl chloride - Aryl halide - Dicarboxylic acid or derivatives - Phosphonic acid ester - Hydropyrimidine - Heteroaromatic compound - Vinylogous amide - Organophosphonic acid derivative - Carboxylic acid ester - Urea - Lactam - Carboxylic acid derivative - Azacycle - Organohalogen compound - Organooxygen compound - Organophosphorus compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organochloride - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as halopyrimidines. These are aromatic compounds containing a halogen atom linked to a pyrimidine ring. 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

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