Structure Information
Structure

Compound Identification

SMILES

Cl.CC1=NC(C)=C(C(=C1)[N+]1([O-])CCOCC1)[N+]([O-])=O

InChIKey

InChIKey=SHMPKNABCUENOC-UHFFFAOYSA-N

Formula

C11H16ClN3O4

Mass

289.72

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic 1,3-dipolar compounds

Class

Allyl-type 1,3-dipolar organic compounds

Subclass

Organic nitro compounds

Intermediate Tree Nodes

C-nitro compounds

Direct Parent

Nitroaromatic compounds

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitroaromatic compound - Methylpyridine - Morpholine - Oxazinane - Pyridine - Heteroaromatic compound - N-oxide - Dialkyl ether - Ether - Organic oxoazanium - Trisubstituted n-oxide - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Oxacycle - Organic oxide - Organic nitrogen compound - Organic salt - Organonitrogen compound - Hydrochloride - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitroaromatic compounds. These are c-nitro compounds where the nitro group is C-substituted with an aromatic group.

External Descriptors

Not available

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