Compound Identification
SMILES
CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(OC1=CC=CC=C1)N(CCCl)CCCl)OC(=O)CCCCCCCC=CCCCCCCCC
InChIKey
InChIKey=OTXOSURQGSBRDE-UHFFFAOYSA-N
Formula
C49H84Cl2NO7P
Mass
901.08
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
Phosphoric diester monoamides Phenoxy compounds Fatty acid esters Organic phosphoramides Dicarboxylic acids and derivatives Carboxylic acid esters Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Phenoxy compound - Nitrogen mustard - Phosphoric diester monoamide - Fatty acid ester - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Organic phosphoric acid derivative - Phosphoric acid ester - Benzenoid - Organic phosphoric acid amide - Fatty acyl - Carboxylic acid ester - Carboxylic acid derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Alkyl halide - Organochloride - Organooxygen compound - Alkyl chloride - Carbonyl group - Hydrocarbon derivative - Aromatic 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