Structure Information
Structure

Compound Identification

SMILES

CC1=CN([C@H]2C[C@H](N=[N+]=[N-])[C@@H](COP(=O)(OC3=CC=CC(=C3)[N+]([O-])=O)OC3=CC=CC(=C3)[N+]([O-])=O)O2)C(=O)NC1=O

InChIKey

InChIKey=OTOARMFQGQSMPB-XUVXKRRUSA-N

Formula

C22H20N7O11P

Mass

589.414

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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

Aryl phosphates

Direct Parent

Aryl phosphotriesters

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Aryl phosphotriester - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Monoalkyl phosphate - Pyrimidone - Alkyl phosphate - Monocyclic benzene moiety - Hydropyrimidine - Benzenoid - Pyrimidine - Heteroaromatic compound - Vinylogous amide - Oxolane - Organic nitro compound - C-nitro compound - Urea - Lactam - Azo imide - Azo compound - Oxacycle - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic nitrogen compound - Organic zwitterion - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as aryl phosphotriesters. These are aryl phosphates in which the phosphate is esterified at exactly three positions.

External Descriptors

Not available

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