Structure Information
Structure

Compound Identification

SMILES

CN1NC=C(N2CCNCC2)\C1=C1/C=C(Br)C(O)=CC1=O

InChIKey

InChIKey=MEVINHVPCNRTAT-ZROIWOOFSA-N

Formula

C14H17BrN4O2

Mass

353.22

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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

Aliphatic heteromonocyclic compounds

Substituents

O-quinomethane - 1,4-diazinane - Piperazine - Pyrazoline - Vinylogous acid - Vinylogous amide - Tertiary amine - Tertiary aliphatic amine - Bromoalkene - Azacycle - Vinyl halide - Vinyl bromide - Haloalkene - Organoheterocyclic compound - Secondary amine - Secondary aliphatic amine - Enamine - Enol - Alkylhydrazine - Amine - Organohalogen compound - Organobromide - Hydrazine derivative - Organonitrogen compound - Organic oxide - Organic nitrogen 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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