Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=C(SC2=NC=NN2)C=CC(C=O)=C1

InChIKey

InChIKey=OVDSWHHRPWESRG-UHFFFAOYSA-N

Formula

C9H6N4O3S

Mass

250.23

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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

Nitrobenzaldehydes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Nitrobenzaldehyde - Diarylthioether - Aryl thioether - Nitroaromatic compound - Benzaldehyde - Benzoyl - Thiophenol ether - Aryl-aldehyde - Azole - Heteroaromatic compound - 1,2,4-triazole - C-nitro compound - Organic nitro compound - Organic oxoazanium - Thioether - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organosulfur compound - Organooxygen compound - Organic nitrogen compound - Organic oxygen compound - Organic salt - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Aldehyde - Organonitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as nitrobenzaldehydes. These are nitrobenzenes that carry an aldehyde group at any position of the benzene ring.

External Descriptors

Not available

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