Structure Information
Structure

Compound Identification

SMILES

OC(CNCCF)CN1C=CN=C1[N+]([O-])=O

InChIKey

InChIKey=PQJWOBYKYGXKRG-UHFFFAOYSA-N

Formula

C8H13FN4O3

Mass

232.215

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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 - N-substituted imidazole - Azole - Imidazole - Heteroaromatic compound - 1,2-aminoalcohol - Secondary alcohol - Secondary aliphatic amine - Organic oxoazanium - Azacycle - Secondary amine - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Alcohol - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Alkyl fluoride - Alkyl halide - Organic zwitterion - Amine - Organic salt - 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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