Structure Information
Structure

Compound Identification

SMILES

OCC(O)CNC(=O)N(CCCl)N=O

InChIKey

InChIKey=ACZWCVBYCKDESV-UHFFFAOYSA-N

Formula

C6H12ClN3O4

Mass

225.63

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic acids and derivatives

Class

Organic carbonic acids and derivatives

Subclass

Ureas

Intermediate Tree Nodes

Not available

Direct Parent

Nitrosoureas

Alternative Parents

Molecular Framework

Aliphatic acyclic compounds

Substituents

Nitrosourea - Semicarbazide - Nitrosamide - Organic n-nitroso compound - 1,2-diol - Secondary alcohol - Organic nitroso compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Primary alcohol - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Carbonyl group - Alkyl halide - Alkyl chloride - Alcohol - Aliphatic acyclic compound

Description

This compound belongs to the class of organic compounds known as nitrosoureas. These are compounds containing a nitro group and an urea group N-N linked together, with the general structure R1N(R2)C(=O)N(R3)N=O.

External Descriptors

Not available

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