Structure Information
Structure

Compound Identification

SMILES

ClCCN(CCCl)P1(=O)NC2=C(N1)C=C(Cl)C=C2

InChIKey

InChIKey=MIZMDRAZEUQGQK-UHFFFAOYSA-N

Formula

C10H13Cl3N3OP

Mass

328.56

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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

Organic phosphoramides Benzenoids Aryl chlorides Azacyclic compounds Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Alkyl chlorides

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrogen mustard - Organic phosphoric acid amide - Benzenoid - Organic phosphoric acid derivative - Aryl halide - Aryl chloride - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organochloride - Organohalogen compound - 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

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