Structure Information
Structure

Compound Identification

SMILES

CCO[P@]1(=O)N=C(NC2=NC(N=C(CC)O2)(C(F)(F)F)C(F)(F)F)N(C)C1(C)C

InChIKey

InChIKey=BENSDSDDRCIBDI-LJAQVGFWSA-N

Formula

C14H20F6N5O3P

Mass

451.31

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Organic phosphonic acids and derivatives

Subclass

Phosphonic acid esters

Intermediate Tree Nodes

Not available

Direct Parent

Phosphonic acid esters

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

1,3,5-oxadiazine - Oxadiazine - Phosphonic acid ester - Guanidine - Isourea - Tertiary amine - Carboximidamide - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organoheterocyclic compound - Azacycle - Oxacycle - Phosphacycle - Hydrocarbon derivative - Organic oxide - Organooxygen compound - Organonitrogen compound - Organofluoride - Alkyl fluoride - Alkyl halide - Amine - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as phosphonic acid esters. These are organic compounds containing phosphonic acid ester functional group, with the general structure ROP(=O)OH (R = organyl group).

External Descriptors

Not available

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