Structure Information
Structure

Compound Identification

SMILES

ClC1=CCCC[C@@H]1NC(=O)C(Cl)(Cl)Cl

InChIKey

InChIKey=OLLHCIWPICQBNN-LURJTMIESA-N

Formula

C8H9Cl4NO

Mass

276.97

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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

Secondary carboxylic acid amides Vinyl chlorides Chloroalkenes Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Alkyl chlorides

Molecular Framework

Aliphatic homomonocyclic compounds

Substituents

Nitrogen mustard - Carboxamide group - Secondary carboxylic acid amide - Carboxylic acid derivative - Vinyl chloride - Vinyl halide - Haloalkene - Chloroalkene - Organooxygen compound - Organochloride - Organohalogen compound - Organic oxide - Hydrocarbon derivative - Alkyl chloride - Alkyl halide - Carbonyl group - Organic oxygen compound - Aliphatic 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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