Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)NC1=NC2=C(S1)C(=O)CCC2

InChIKey

InChIKey=WNJVXIPCUJFTSK-UHFFFAOYSA-N

Formula

C7H7N3O3S

Mass

213.21

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic oxygen compounds

Class

Organooxygen compounds

Subclass

Carbonyl compounds

Intermediate Tree Nodes

Ketones - Aryl ketones

Direct Parent

Aryl alkyl ketones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Aryl alkyl ketone - Azole - Nitramine - Thiazole - Heteroaromatic compound - Organic nitro compound - Organoheterocyclic compound - Organic 1,3-dipolar compound - Allyl-type 1,3-dipolar organic compound - Azacycle - Organic salt - Organic nitrogen compound - Organic zwitterion - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as aryl alkyl ketones. These are ketones have the generic structure RC(=O)R', where R = aryl group and R'=alkyl group.

External Descriptors

Not available

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