Structure Information
Structure

Compound Identification

SMILES

CC1=C(C([O-])=NC=C1[N+]([O-])=O)[N+]([O-])=O

InChIKey

InChIKey=NCXXHBCMRXSTLW-UHFFFAOYSA-M

Formula

C6H4N3O5

Mass

198.115

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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 - Pyridinolate - Methylpyridine - Pyridine - Heteroaromatic compound - Organic oxoazanium - Organoheterocyclic compound - Azacycle - Organonitrogen compound - Organic salt - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - 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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