Structure Information
Structure

Compound Identification

SMILES

CCCCOP(=O)(OCCCC)OCCCC.CS(=O)(=O)C1=CC(=C(C=C1)C(=O)C1C(=O)CCCC1=O)[N+]([O-])=O

InChIKey

InChIKey=CIPMTLHLHZRSGV-UHFFFAOYSA-N

Formula

C26H40NO11PS

Mass

605.64

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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

Not available

Substituents

Benzoylcyclohexane-1,3-dione - Benzenesulfonyl group - Nitrobenzene - Nitroaromatic compound - Benzoyl - Aryl alkyl ketone - Trialkyl phosphate - 1,3-diketone - Monocyclic benzene moiety - Organic phosphoric acid derivative - Phosphoric acid ester - 1,3-dicarbonyl compound - Benzenoid - Alkyl phosphate - Sulfone - Sulfonyl - C-nitro compound - Organic nitro compound - Cyclic ketone - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Organic nitrogen compound - Organic oxide - Organonitrogen compound - Organosulfur compound - Organic salt - Hydrocarbon derivative - Organic cation - Aromatic homomonocyclic 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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