Structure Information
Structure

Compound Identification

SMILES

CN(C)CC1=CC(C=CC(=O)C2=CC=C(Br)C=C2)=CC(CN(C)C)=C1O

InChIKey

InChIKey=KHLXXSIJHPFZPM-UHFFFAOYSA-N

Formula

C21H25BrN2O2

Mass

417.347

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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 - Cinnamylphenol - Cinnamic acid or derivatives - Hydroxycinnamic acid or derivatives - Benzoyl - Benzylamine - Phenylmethylamine - Styrene - Aryl ketone - Bromobenzene - Halobenzene - Phenol - Aralkylamine - Aryl bromide - Benzenoid - Aryl halide - Monocyclic benzene moiety - Alpha,beta-unsaturated ketone - Acryloyl-group - Enone - Tertiary amine - Tertiary aliphatic amine - Ketone - Hydrocarbon derivative - Amine - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organohalogen compound - Organobromide - 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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