Structure Information
Structure

Compound Identification

SMILES

CC1=CC(=C(C)C=C1)S(=O)(=O)NC1=C(C=C(C2=CC=CC=C12)[N+]([O-])=O)[N+]([O-])=O

InChIKey

InChIKey=FRBKMGZRSJATSW-UHFFFAOYSA-N

Formula

C18H15N3O6S

Mass

401.39

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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

2-nitronaphthalene - 1-nitronaphthalene - Sulfanilide - Benzenesulfonamide - Benzenesulfonyl group - P-xylene - Xylene - Nitroaromatic compound - Organosulfonic acid amide - Monocyclic benzene moiety - Aminosulfonyl compound - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - C-nitro compound - Organic nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organic oxygen compound - Organosulfur compound - Organonitrogen compound - Organic salt - Hydrocarbon derivative - 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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