Structure Information
Structure

Compound Identification

SMILES

ClC1=C(OCCN2C=NN=N2)C(Cl)=C(C=C1)C(=O)C1C(=O)CCCC1=O

InChIKey

InChIKey=NDEGQDKRNJHKOL-UHFFFAOYSA-N

Formula

C16H14Cl2N4O4

Mass

397.21

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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 - Aryl ketones - Phenylketones - Alkyl-phenylketones

Direct Parent

Benzoylcyclohexane-1,3-diones

Alternative Parents

Molecular Framework

Aromatic heteromonocyclic compounds

Substituents

Benzoylcyclohexane-1,3-dione - Benzoyl - Phenoxy compound - 1,3-dichlorobenzene - Phenol ether - Aryl alkyl ketone - Alkyl aryl ether - Chlorobenzene - Halobenzene - 1,3-diketone - Aryl halide - Monocyclic benzene moiety - Aryl chloride - 1,3-dicarbonyl compound - Benzenoid - Tetrazole - Vinylogous halide - Azole - Heteroaromatic compound - Cyclic ketone - Organoheterocyclic compound - Ether - Azacycle - Hydrocarbon derivative - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxide - Organic nitrogen compound - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as benzoylcyclohexane-1,3-diones. These are alkyl-phenylketones where the alkyl group is a cyclohexane 1,3-dione.

External Descriptors

Not available

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