Structure Information
Structure

Compound Identification

SMILES

CCOC(=O)C(=C\C1=CC=CC=C1[N+]([O-])=O)\C(=O)C1=CC=CC=C1

InChIKey

InChIKey=DWRIXGMCPXRTRU-NTCAYCPXSA-N

Formula

C18H15NO5

Mass

325.32

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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 homomonocyclic compounds

Substituents

Retrochalcone - Cinnamic acid or derivatives - Cinnamic acid ester - Nitrobenzene - Benzoyl - Nitroaromatic compound - Aryl ketone - Beta-keto acid - Fatty acid ester - Alpha-branched alpha,beta-unsaturated-ketone - Monocyclic benzene moiety - Fatty acyl - Benzenoid - Keto acid - Alpha,beta-unsaturated ketone - Acryloyl-group - Alpha,beta-unsaturated carboxylic ester - Enoate ester - Enone - Organic nitro compound - Carboxylic acid ester - Ketone - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organic oxoazanium - Organic oxide - Organic nitrogen compound - Organic salt - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Organic cation - Aromatic homomonocyclic 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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