Structure Information
Structure

Compound Identification

SMILES

[Na+].OC1=C(N\N=C2/C(=O)C=C(C3=C2C=CC=C3[N+]([O-])=O)S([O-])(=O)=O)C=CC2=CC=CC=C12

InChIKey

InChIKey=BRNZPCZHVVYLOI-GXTSIBQPSA-M

Formula

C20H12N3NaO7S

Mass

461.38

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Benzenoids

Class

Naphthalenes

Subclass

Nitronaphthalenes

Intermediate Tree Nodes

Not available

Direct Parent

Nitronaphthalenes

Alternative Parents

Molecular Framework

Aromatic homopolycyclic compounds

Substituents

1-nitronaphthalene - 1-naphthol - Nitroaromatic compound - Phenylhydrazine - 1-hydroxy-4-unsubstituted benzenoid - Phenol - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Ketone - C-nitro compound - Organic nitro compound - Cyclic ketone - Hydrazone - Organic oxoazanium - Organic alkali metal salt - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic sodium salt - Organic salt - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organic cation - Aromatic homopolycyclic compound

Description

This compound belongs to the class of organic compounds known as nitronaphthalenes. These are polycyclic aromatic compounds containing a naphthalene moiety substituted by one or more nitro groups.

External Descriptors

Not available

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