Structure Information
Structure

Compound Identification

SMILES

OCCNC=C1C(=O)N(N=C1C1=CC=C(C=C1)[N+]([O-])=O)C1=CC=C(C=C1)[N+]([O-])=O

InChIKey

InChIKey=LGVBTZXHANATCI-UHFFFAOYSA-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 heteromonocyclic compounds

Substituents

Nitrobenzene - Nitroaromatic compound - Pyrazolinone - Pyrazoline - Vinylogous amide - 1,2-aminoalcohol - C-nitro compound - Organic nitro compound - Azacycle - Alkanolamine - Carboxylic acid derivative - Secondary aliphatic amine - Enamine - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Allylamine - Organoheterocyclic compound - Organonitrogen compound - Carbonyl group - Organooxygen compound - Primary alcohol - Organic oxygen compound - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Amine - Organic salt - Alcohol - Organic nitrogen compound - Aromatic heteromonocyclic 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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