Structure Information
Structure

Compound Identification

SMILES

CC1=NC=C(COP(O)(O)=O)C(=CN)C1=O

InChIKey

InChIKey=FJABCQPZIJTJSK-UHFFFAOYSA-N

Formula

C8H11N2O5P

Mass

246.159

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Organic phosphoric acids and derivatives

Subclass

Phosphate esters

Intermediate Tree Nodes

Alkyl phosphates

Direct Parent

Monoalkyl phosphates

Alternative Parents

Molecular Framework

Aliphatic heteromonocyclic compounds

Substituents

Dihydropyridine - Monoalkyl phosphate - Hydropyridine - Vinylogous amide - Ketimine - Cyclic ketone - Ketone - Enamine - Allylamine - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Primary amine - Hydrocarbon derivative - Imine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Aliphatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as monoalkyl phosphates. These are organic compounds containing a phosphate group that is linked to exactly one alkyl chain.

External Descriptors

Not available

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