Structure Information
Structure

Compound Identification

SMILES

CN1CCC(OP(=O)(NCC2=CC=CC=C2)N(CCCl)CCCl)=CC1

InChIKey

InChIKey=WCTCITAAGCWGMK-UHFFFAOYSA-N

Formula

C17H26Cl2N3O2P

Mass

406.29

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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

Nitrogen mustard - Phosphoric monoester diamide - Monocyclic benzene moiety - Hydropyridine - Organic phosphoric acid derivative - Phosphoric acid ester - Benzenoid - Organic phosphoric acid amide - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Azacycle - Alkyl chloride - Organooxygen compound - Organochloride - Amine - Organohalogen compound - Organic oxygen compound - Organopnictogen compound - Alkyl halide - Hydrocarbon derivative - Organic oxide - 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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