Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(OP(=O)(OCCCCOP(=O)(OC2=CC=C(C=C2)[N+]([O-])=O)OC2=CC=C(C=C2)[N+]([O-])=O)OC2=CC=C(C=C2)[N+]([O-])=O)C=C1
InChIKey
InChIKey=PELQCKMCZWVHIH-UHFFFAOYSA-N
Formula
C28H24N4O16P2
Mass
734.46
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 phosphotriesters
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Level 5
Aryl phosphates
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Subclass
Phosphate esters
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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 phosphotriesters
Alternative Parents
Nitrobenzenes Phenoxy compounds Nitroaromatic compounds Monoalkyl phosphates Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Aryl phosphotriester - Nitrobenzene - Phenoxy compound - Nitroaromatic compound - Monoalkyl phosphate - Monocyclic benzene moiety - Alkyl phosphate - Benzenoid - C-nitro compound - Organic nitro compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic 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