Structure Information
Structure

Compound Identification

SMILES

O=C(\C(=C/C1=CC=C(C=C1)C#N)C#N)C1=CC=CC=C1

InChIKey

InChIKey=MWWFOFPTOCNHDM-YBEGLDIGSA-N

Formula

C17H10N2O

Mass

258.28

Export to:

JSON SDF CSV

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 - Benzonitrile - Benzoyl - Aryl ketone - Monocyclic benzene moiety - Benzenoid - Alpha-branched alpha,beta-unsaturated-ketone - Enone - Alpha,beta-unsaturated ketone - Acryloyl-group - Ketone - Nitrile - Carbonitrile - Organic oxide - Organooxygen compound - Organonitrogen compound - Cyanide - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - 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

Previous Back Next