Compound Identification
SMILES
CCOP(=O)(OCC)C1(CC(=NN1)C(=O)C1=CC(Br)=CC=C1)P(=O)(OCC)OCC
InChIKey
InChIKey=QBZWEGKDWOIQFX-UHFFFAOYSA-N
Formula
C18H27BrN2O7P2
Mass
525.273
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic acids and derivatives
-
Class
Organic phosphonic acids and derivatives
- Subclass Bisphosphonates
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Class
Organic phosphonic acids and derivatives
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Superclass
Organic acids and derivatives
Kingdom
Organic compounds
Superclass
Organic acids and derivatives
Class
Organic phosphonic acids and derivatives
Subclass
Bisphosphonates
Intermediate Tree Nodes
Not available
Direct Parent
Bisphosphonates
Alternative Parents
Benzoyl derivatives Aryl ketones Dialkyl alkylphosphonates Bromobenzenes Phosphonic acid esters Aryl bromides Pyrazolines N-alkylated hydrazones Azacyclic compounds Organophosphorus compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Bisphosphonate - Benzoyl - Aryl ketone - Dialkyl alkylphosphonate - Bromobenzene - Phosphonic acid diester - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Benzenoid - Phosphonic acid ester - Pyrazoline - N-alkylated hydrazone - Ketone - Azacycle - Organoheterocyclic compound - Hydrazone - Organooxygen compound - Organic oxygen compound - Organophosphorus compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as bisphosphonates. These are organic compounds containing two phosphonate groups linked together through a carbon atoms.
External Descriptors
Not available