Compound Identification
SMILES
ClC1=CC=C(C=CC(=O)C2=CC=C(Br)C=C2)C=C1
InChIKey
InChIKey=HYCQSDMDGCPEPI-UHFFFAOYSA-N
Formula
C15H10BrClO
Mass
321.6
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Phenylpropanoids and polyketides
-
Class
Linear 1,3-diarylpropanoids
-
Subclass
Chalcones and dihydrochalcones
- Level 5 Retrochalcones
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Subclass
Chalcones and dihydrochalcones
-
Class
Linear 1,3-diarylpropanoids
-
Superclass
Phenylpropanoids and polyketides
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
Cinnamic acids and derivatives Styrenes Benzoyl derivatives Aryl ketones Chlorobenzenes Bromobenzenes Aryl chlorides Aryl bromides Enones Acryloyl compounds Organochlorides Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retrochalcone - Cinnamic acid or derivatives - Benzoyl - Styrene - Aryl ketone - Bromobenzene - Chlorobenzene - Halobenzene - Benzenoid - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Alpha,beta-unsaturated ketone - Acryloyl-group - Enone - Ketone - Organohalogen compound - Organobromide - Hydrocarbon derivative - Organochloride - Organooxygen compound - Organic oxygen compound - Organic oxide - 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