Structure Information
Structure

Compound Identification

SMILES

CC1=CC(NC2=NC(NN\C=C3\C=C(Br)C=CC3=O)=NC(=N2)N2CCOCC2)=C(C)C=C1

InChIKey

InChIKey=CEKVVJICESAKBR-SSZFMOIBSA-N

Formula

C22H24BrN7O2

Mass

498.385

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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

2,4-diamine-s-triazine - P-xylene - Xylene - O-quinomethane - Dialkylarylamine - Aniline or substituted anilines - Amino-1,3,5-triazine - Aminotriazine - Monocyclic benzene moiety - Morpholine - Oxazinane - Triazine - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Vinylogous amide - Azacycle - Dialkyl ether - Oxacycle - Bromoalkene - Haloalkene - Organoheterocyclic compound - Ether - Vinyl bromide - Vinyl halide - Hydrocarbon derivative - Organohalogen compound - Organobromide - Organonitrogen compound - Organic oxide - Hydrazine derivative - Organic nitrogen compound - Amine - 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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