Compound Identification
SMILES
OC1=C(C#N)C(OP(O)(O)=O)=C(C#N)C(O)=C1C#N
InChIKey
InChIKey=SAQLHVCPVJHPES-UHFFFAOYSA-N
Formula
C9H4N3O6P
Mass
281.12
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Organic phosphoric acids and derivatives
-
Subclass
Phosphate esters
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Level 5
Aryl phosphates
-
Level 6
Aryl phosphomonoesters
- Level 7 Phenyl phosphates
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Level 6
Aryl phosphomonoesters
-
Level 5
Aryl phosphates
-
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 - Aryl phosphomonoesters
Direct Parent
Phenyl phosphates
Alternative Parents
Resorcinols Phenoxy compounds Benzonitriles Nitriles Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenyl phosphate - 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 phenyl phosphates. These are aromatic organooxygen compounds containing a phosphate group, which is O-esterified with a phenyl group.
External Descriptors
Not available