Structure Information
Structure

Compound Identification

SMILES

[O-][N+](=O)C1=CC=C(C=C1)C(=O)\C=C(\N1N=NC2=CC=CC=C12)C1=CC=CC=C1

InChIKey

InChIKey=LFQVPPUAUCDMSZ-XSFVSMFZSA-N

Formula

C21H14N4O3

Mass

370.368

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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 - Cinnamic acid or derivatives - Benzotriazole - Nitrobenzene - Nitroaromatic compound - Styrene - Benzoyl - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Triazole - 1,2,3-triazole - Acryloyl-group - Enone - Alpha,beta-unsaturated ketone - Vinylogous amide - Heteroaromatic compound - Azole - Organic nitro compound - C-nitro compound - Ketone - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic oxygen compound - Organic salt - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic zwitterion - 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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