Compound Identification
SMILES
NC1CCCCC1.CC(=O)NP(O)(=O)N(CCCl)CCCl
InChIKey
InChIKey=CAYFMNYEWIHRMI-UHFFFAOYSA-N
Formula
C12H26Cl2N3O3P
Mass
362.23
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic nitrogen compounds
-
Class
Organonitrogen compounds
- Subclass Nitrogen mustard compounds
-
Class
Organonitrogen compounds
-
Superclass
Organic nitrogen compounds
Kingdom
Organic compounds
Superclass
Organic nitrogen compounds
Class
Organonitrogen compounds
Subclass
Nitrogen mustard compounds
Intermediate Tree Nodes
Not available
Direct Parent
Nitrogen mustard compounds
Alternative Parents
Cyclohexylamines Organic phosphoramides Acetamides Organochlorides Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Not available
Substituents
Nitrogen mustard - Cyclohexylamine - Organic phosphoric acid amide - Organic phosphoric acid derivative - Acetamide - Carboxylic acid derivative - Alkyl chloride - Organooxygen compound - Organochloride - Primary amine - Organohalogen compound - Hydrocarbon derivative - Primary aliphatic amine - Organic oxide - Organic oxygen compound - Carbonyl group - Amine - Alkyl halide - Aliphatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as nitrogen mustard compounds. These are compounds having two beta-haloalkyl groups bound to a nitrogen atom.
External Descriptors
Not available