Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=NCCCCN=CC2=C(C)C=C(C=C2)N(CCCl)CCCl)C=CC(=C1)N(CCCl)CCCl

InChIKey

InChIKey=XUGNPAKVJGUPLR-UHFFFAOYSA-N

Formula

C28H38Cl4N4

Mass

572.44

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Taxonomic Classification

Taxonomy Tree

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

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

Aminotoluene - Aniline or substituted anilines - Dialkylarylamine - Nitrogen mustard - Tertiary aliphatic/aromatic amine - Toluene - Monocyclic benzene moiety - Benzenoid - Shiff base - Tertiary amine - Aldimine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organochloride - Organohalogen compound - Imine - Hydrocarbon derivative - Amine - Alkyl halide - Alkyl chloride - 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

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