Structure Information
Structure

Compound Identification

SMILES

CC(C)C1(OC2(O)CCCCCN2C1=O)C(=O)NNC(=O)CCCC1=CC=C(C=C1)N(CCCl)CCCl

InChIKey

InChIKey=LHMAOGJRVUBHGZ-UHFFFAOYSA-N

Formula

C26H38Cl2N4O5

Mass

557.51

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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 heteropolycyclic compounds

Substituents

Nitrogen mustard - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Azepane - Diacylhydrazine - Monocyclic benzene moiety - Oxazolidinone - Benzenoid - Oxazolidine - Tertiary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Carboxylic acid hydrazide - Lactam - Orthocarboxylic acid derivative - Tertiary amine - Organoheterocyclic compound - Azacycle - Oxacycle - Alkanolamine - Carboxylic acid derivative - Organooxygen compound - Alkyl halide - Amine - Alkyl chloride - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Organochloride - 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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