Structure Information
Structure

Compound Identification

SMILES

CCOC1=CC(Br)=C\C(=C\NNC(=O)C2=C(C)ON=C2C2=CC=CC=C2)C1=O

InChIKey

InChIKey=LKEMSNXEHCFSRN-KAMYIIQDSA-N

Formula

C20H18BrN3O4

Mass

444.285

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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

O-quinomethane - Monocyclic benzene moiety - Benzenoid - Azole - Isoxazole - Heteroaromatic compound - Vinylogous amide - Carboxylic acid hydrazide - Carboxylic acid derivative - Oxacycle - Vinyl bromide - Vinyl halide - Azacycle - Bromoalkene - Organoheterocyclic compound - Haloalkene - Organohalogen compound - Organobromide - Organonitrogen compound - Organic nitrogen compound - Organopnictogen compound - Aldehyde - Organic oxide - Hydrocarbon derivative - 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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