Structure Information
Structure

Compound Identification

SMILES

CC(=O)C1=CC(=C(I)S1)[N+]([O-])=O

InChIKey

InChIKey=NJNNJEAOUONWGX-UHFFFAOYSA-N

Formula

C6H4INO3S

Mass

297.07

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organoheterocyclic compounds

Class

Thiophenes

Subclass

Nitrothiophenes

Intermediate Tree Nodes

Nitrohalothiophenes

Direct Parent

3-nitrohalothiophenes

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

3-nitrohalothiophene - 3-nitrothiophene - Nitroaromatic compound - Aryl alkyl ketone - Aryl ketone - 2,3,5-trisubstituted thiophene - Alpha-branched alpha,beta-unsaturated-ketone - Heteroaromatic compound - Alpha,beta-unsaturated ketone - Enone - Acryloyl-group - Organic nitro compound - Thioenolether - C-nitro compound - Ketone - Iodoalkene - Haloalkene - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Sulfenyl compound - Vinyl iodide - Vinyl halide - Organic oxoazanium - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organoiodide - Organic hyponitrite - Organohalogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as 3-nitrohalothiophenes. These are aromatic heterocyclic compound containing a thiophene ring that carries a nitro group attached at the 3-position, as well as an halogen atom.

External Descriptors

Not available

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