Structure Information
Structure

Compound Identification

SMILES

OCCOCCN=C1C=C(C=CN1O)[N+]([O-])=O

InChIKey

InChIKey=JJYWOZWWTSSRPJ-UHFFFAOYSA-N

Formula

C9H13N3O5

Mass

243.219

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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 - Dihydropyridine - Hydropyridine - Pyridine - Imidolactam - Heteroaromatic compound - Dialkyl ether - Ether - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Organic oxide - Primary alcohol - Organooxygen compound - Organonitrogen compound - Alcohol - Organic zwitterion - Organic nitrogen compound - Organic salt - Hydrocarbon derivative - Organic oxygen compound - 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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