Structure Information
Structure

Compound Identification

SMILES

OC1=C(O)C(Cl)=CC(\C=C\C(=O)C2=CC3=C(OCC(=O)N3)C=C2)=C1

InChIKey

InChIKey=YKRMTOLRDSKSHE-HNQUOIGGSA-N

Formula

C17H12ClNO5

Mass

345.74

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Phenylpropanoids and polyketides

Class

Linear 1,3-diarylpropanoids

Subclass

Chalcones and dihydrochalcones

Intermediate Tree Nodes

Not available

Direct Parent

Retrochalcones

Alternative Parents

Molecular Framework

Aromatic heteropolycyclic compounds

Substituents

Retrochalcone - Hydroxycinnamic acid or derivatives - Cinnamic acid or derivatives - Benzoxazinone - Benzoxazine - Benzomorpholine - 3-chlorocatechol - Chlorocatechol - 3-halophenol - 2-halophenol - 3-chlorophenol - 2-chlorophenol - Catechol - Styrene - Aryl ketone - Phenol - Alkyl aryl ether - Chlorobenzene - 1-hydroxy-4-unsubstituted benzenoid - 1-hydroxy-2-unsubstituted benzenoid - Halobenzene - Oxazinane - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - Enone - Acryloyl-group - Alpha,beta-unsaturated ketone - Secondary carboxylic acid amide - Carboxamide group - Lactam - Ketone - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Oxacycle - Ether - Organochloride - Organonitrogen compound - Organic oxygen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organic oxide - Aromatic heteropolycyclic compound

Description

This compound belongs to the class of organic compounds known as retrochalcones. These are a form of normal chalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.

External Descriptors

Not available

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