Structure Information
Structure

Compound Identification

SMILES

[Na+].CC1=CC(C)=C(CCCC(=O)C2=CC=C(OC3=C(Cl)C=C4C(CCOC4=C3)C([O-])=O)C=C2)C=C1

InChIKey

InChIKey=NZCZGOGXBSUAHW-UHFFFAOYSA-M

Formula

C28H26ClNaO5

Mass

500.95

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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

Direct Parent

Alkyl-phenylketones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Alkyl-phenylketone - Butyrophenone - Diaryl ether - Chromane - Benzopyran - 1-benzopyran - Phenoxy compound - Benzoyl - M-xylene - Phenol ether - Xylene - Aryl alkyl ketone - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Carboxylic acid salt - Oxacycle - Organic alkali metal salt - Organoheterocyclic compound - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organic metal halide - Hydrocarbon derivative - Organochloride - Organic oxide - Organic salt - Organohalogen compound - Organic sodium salt - Organic cation - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as alkyl-phenylketones. These are aromatic compounds containing a ketone substituted by one alkyl group, and a phenyl group.

External Descriptors

Not available

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