Compound Identification
SMILES
OC1=C(C#N)C(OP(O)(=O)OC2=C(C#N)C(O)=C(C#N)C(O)=C2C#N)=C(C#N)C(O)=C1C#N
InChIKey
InChIKey=WHDYZHKBHPTQPD-UHFFFAOYSA-N
Formula
C18H5N6O8P
Mass
464.246
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organic acids and derivatives
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Class
Organic phosphoric acids and derivatives
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Subclass
Phosphate esters
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Level 5
Aryl phosphates
- Level 6 Aryl phosphodiesters
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Level 5
Aryl phosphates
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Subclass
Phosphate esters
-
Class
Organic phosphoric acids and derivatives
-
Superclass
Organic acids and derivatives
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 phosphodiesters
Alternative Parents
Resorcinols Phenoxy compounds Benzonitriles Nitriles Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aryl phosphodiester - Phenoxy compound - Benzonitrile - Resorcinol - Phenol - Monocyclic benzene moiety - Benzenoid - Carbonitrile - Nitrile - Cyanide - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as aryl phosphodiesters. These are aryl phosphates in which the phosphate is esterified at exactly two positions.
External Descriptors
Not available