Structure Information
Structure

Compound Identification

SMILES

CC1=C(C=CO1)C(=O)NN\C=C1/C=C(Br)C=C(C1=O)[N+]([O-])=O

InChIKey

InChIKey=XDWGPQLSNWVQEY-SOFGYWHQSA-N

Formula

C13H10BrN3O5

Mass

368.143

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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 heteromonocyclic compounds

Substituents

Furoic acid or derivatives - Furan-3-carboxylic acid or derivatives - O-quinomethane - Furan - Heteroaromatic compound - Vinylogous amide - Carboxylic acid hydrazide - C-nitro compound - Organic nitro compound - Carboxylic acid derivative - Organic oxoazanium - Vinyl bromide - Vinyl halide - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Oxacycle - Organoheterocyclic compound - Haloalkene - Bromoalkene - Aldehyde - Organic nitrogen compound - Organic zwitterion - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organohalogen compound - Organobromide - Organonitrogen compound - Aromatic heteromonocyclic 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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