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Structure Information
Structure

Compound Identification

SMILES

OC1COC2(N=NC3=CC=C(C=C3)[N+]([O-])=O)C1OC(=O)\C2=N/NC1=CC=CC=C1

InChIKey

InChIKey=PHUNPIGGZFZUNH-MZGQFTPUSA-N

Formula

C18H15N5O6

Mass

397.347

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Benzene and substituted derivatives

Subclass

Nitrobenzenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitrobenzenes

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Nitrobenzene - Nitroaromatic compound - Furofuran - Phenylhydrazine - Gamma butyrolactone - Oxolane - Azo compound - Carboxylic acid ester - Lactone - Organic nitro compound - C-nitro compound - Secondary alcohol - Carboxylic acid derivative - Hydrazone - Oxacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carbonyl group - Organic nitrogen compound - Alcohol - Organic salt - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzenes. These are compounds containing a nitrobenzene moiety, which consists of a benzene ring with a carbon bearing a nitro group.

External Descriptors

Not available

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