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Structure Information
Structure

Compound Identification

SMILES

CCCCCCCCC=CCCCCCCCC(=O)OCC(COP(=O)(OC1=CC=CC=C1)N(CCCl)CCCl)OC(=O)CCCCCCCC=CCCCCCCCC

InChIKey

InChIKey=OTXOSURQGSBRDE-UHFFFAOYSA-N

Formula

C49H84Cl2NO7P

Mass

901.08

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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

Phenoxy compound - Nitrogen mustard - Phosphoric diester monoamide - Fatty acid ester - Monocyclic benzene moiety - Dicarboxylic acid or derivatives - Organic phosphoric acid derivative - Phosphoric acid ester - Benzenoid - Organic phosphoric acid amide - Fatty acyl - Carboxylic acid ester - Carboxylic acid derivative - Organohalogen compound - Organic oxide - Organic oxygen compound - Alkyl halide - Organochloride - Organooxygen compound - Alkyl chloride - Carbonyl group - Hydrocarbon derivative - 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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