Compound Identification
SMILES
[Fe++].ClCCN(CCCl)C1=CC=C(C=N[C-]2C=CC=C2)C=C1
InChIKey
InChIKey=XTFDSDYUJXZTKZ-UHFFFAOYSA-N
Formula
C16H17Cl2FeN2
Mass
364.07
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
Dialkylarylamines Aniline and substituted anilines Shiff bases Organic transition metal salts Organic metal halides Organochlorides Hydrocarbon derivatives Alkyl chlorides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Nitrogen mustard - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Monocyclic benzene moiety - Benzenoid - Shiff base - Tertiary amine - Organic transition metal salt - Aldimine - Organic metal halide - Alkyl chloride - Organochloride - Organohalogen compound - Hydrocarbon derivative - Imine - Amine - Alkyl halide - Organic salt - Organic cation - 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