Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC(=CNNC(=S)C2=CC=CC=C2)C(=O)C(Br)=C1

InChIKey

InChIKey=ZAEOYKFMGLEQDO-UHFFFAOYSA-N

Formula

C14H10BrN3O3S

Mass

380.22

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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 - Cyclic ketones - Quinomethanes

Direct Parent

O-quinomethanes

Alternative Parents

Molecular Framework

Aromatic homomonocyclic compounds

Substituents

O-quinomethane - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Vinylogous amide - Thioamide - C-nitro compound - Organic nitro compound - Bromoalkene - Haloalkene - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Vinyl halide - Vinyl bromide - Organic nitrogen compound - Organic oxide - Thiocarbonyl group - Organosulfur compound - Organonitrogen compound - Organobromide - Organic salt - Organohalogen compound - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic compound

Description

This compound belongs to the class of organic compounds known as o-quinomethanes. These are organic compounds containing a benzene ring conjugated to a methylidene group and a ketone at carbon atoms 1 and 2, respectively.

External Descriptors

Not available

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