Compound Identification
SMILES
CC1(C)OC2OC3C(OC(OC3CN(CCCl)CCCl)C3=CC=CC=C3)C2O1
InChIKey
InChIKey=NFOKPPOIHRJGGO-UHFFFAOYSA-N
Formula
C20H27Cl2NO5
Mass
432.34
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
Ketals Monosaccharides Benzene and substituted derivatives 1,3-dioxanes Tetrahydrofurans 1,3-dioxolanes Trialkylamines Oxacyclic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Nitrogen mustard - Ketal - Benzenoid - Monosaccharide - Monocyclic benzene moiety - Meta-dioxane - Tetrahydrofuran - Meta-dioxolane - Tertiary aliphatic amine - Tertiary amine - Oxacycle - Organoheterocyclic compound - Acetal - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organooxygen compound - Organochloride - Organohalogen compound - Amine - Alkyl halide - Alkyl chloride - Aromatic heteropolycyclic 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