Structure Information
Structure

Compound Identification

SMILES

S\C(N1CCOCC1)=C1/C=C(Br)C=CC1=O

InChIKey

InChIKey=WKSJXXONIJBEOJ-PKNBQFBNSA-N

Formula

C11H12BrNO2S

Mass

302.19

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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

Aliphatic heteromonocyclic compounds

Substituents

O-quinomethane - Morpholine - Oxazinane - Vinylogous amide - Ketene acetal or derivatives - Oxacycle - Azacycle - Bromoalkene - Haloalkene - Organoheterocyclic compound - Vinyl halide - Vinyl bromide - Alkylthiol - Dialkyl ether - Ether - Organic oxide - Organohalogen compound - Organic nitrogen compound - Organobromide - Organonitrogen compound - Organosulfur compound - Hydrocarbon derivative - Aliphatic 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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