Compound Identification
SMILES
CN(C)C1=CC=C(CN2CCCN(CC3=CC=C(C=C3)N(C)C)C2C2=C(C)C=C(C=C2)N(CCCl)CCCl)C=C1
InChIKey
InChIKey=XLBCXZQJEFWFAS-UHFFFAOYSA-N
Formula
C33H45Cl2N5
Mass
582.66
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 Benzylamines Aniline and substituted anilines Aminotoluenes Diazinanes Azacyclic compounds Organopnictogen compounds Organochlorides Hydrocarbon derivatives Alkyl chlorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Benzylamine - Nitrogen mustard - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aminotoluene - Toluene - Benzenoid - 1,3-diazinane - Monocyclic benzene moiety - Tertiary amine - Organoheterocyclic compound - Azacycle - Amine - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteromonocyclic 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