Compound Identification
SMILES
CCOP(=O)(OCC)C1=C(NC(=O)OC(C)(C)C)OC(C2=CC=CC=C2)=C(C#N)C1=S
InChIKey
InChIKey=PTAHXVFVSVLHJY-UHFFFAOYSA-N
Formula
C21H25N2O6PS
Mass
464.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Organic phosphonic acids and derivatives
- Subclass Phosphonic acid diesters
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Class
Organic phosphonic acids and derivatives
-
Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic phosphonic acids and derivatives
Subclass
Phosphonic acid diesters
Intermediate Tree Nodes
Not available
Direct Parent
Phosphonic acid diesters
Alternative Parents
Phosphonic acid esters Benzene and substituted derivatives Heteroaromatic compounds Carbamate esters Oxacyclic compounds Nitriles Organosulfur compounds Organophosphorus compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phosphonic acid diester - Monocyclic benzene moiety - Phosphonic acid ester - Benzenoid - Carbamic acid ester - Heteroaromatic compound - Oxacycle - Organoheterocyclic compound - Nitrile - Carbonitrile - Organic oxide - Cyanide - Organic oxygen compound - Organosulfur compound - Organophosphorus compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phosphonic acid diesters. These are organophosphorus compounds containing a diester derivative of phosphonic acid, with the general structure ROP(=O)OR' (R,R' = organyl group).
External Descriptors
Not available