Structure Information
Structure

Compound Identification

SMILES

CN1C(COP(=O)(N(CCBr)CCBr)N(CCBr)CCBr)=CC=C1[N+]([O-])=O

InChIKey

InChIKey=OKJAJRBADWQNRC-UHFFFAOYSA-N

Formula

C14H23Br4N4O4P

Mass

661.952

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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 heteromonocyclic compounds

Substituents

Nitroaromatic compound - Nitrogen mustard - Phosphoric monoester diamide - N-methylpyrrole - Organic phosphoric acid derivative - Phosphoric acid ester - Organic phosphoric acid amide - Substituted pyrrole - Heteroaromatic compound - Pyrrole - C-nitro compound - Organic nitro compound - Organic oxoazanium - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organooxygen compound - Organobromide - Alkyl halide - Alkyl bromide - Organohalogen compound - Organic salt - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic cation - 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

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