Structure Information
Structure

Compound Identification

SMILES

COC1=CC(=CC(OC)=C1OC)C1=NN2C(S1)=NC(=O)N(C1=CC=C(C=C1)[N+]([O-])=O)C2=O

InChIKey

InChIKey=CWSKSGJEEFAVNZ-UHFFFAOYSA-N

Formula

C19H15N5O7S

Mass

457.42

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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 - Phenoxy compound - Nitroaromatic compound - Anisole - Methoxybenzene - Phenol ether - Alkyl aryl ether - Triazinone - 1,3,5-triazine - Triazine - Azole - Heteroaromatic compound - Thiadiazole - C-nitro compound - Organic nitro compound - Ether - Azacycle - Organic oxoazanium - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Organic salt - Organic nitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organic cation - 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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