Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC2=C(N\N=C/N=NC3=C(OCCCO2)C=C(C=C3)[N+]([O-])=O)C=C1

InChIKey

InChIKey=NBTOQCLPXYEQHW-OPSMPBDOSA-N

Formula

C16H14N6O6

Mass

386.324

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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 heteropolycyclic compounds

Substituents

Nitroaromatic compound - Alkyl aryl ether - Benzenoid - Azo compound - Ether - Hydrazone - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Organoheterocyclic compound - Azacycle - Oxacycle - Organic zwitterion - Organooxygen compound - Organic oxide - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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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