Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(C=C1)[C@@H](Br)[C@H](Br)C(=O)C1=CC=C(OC(F)F)C=C1
InChIKey
InChIKey=MGBFLOWZOCIWBB-KGLIPLIRSA-N
Formula
C16H11Br2F2NO4
Mass
479.072
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Linear 1,3-diarylpropanoids
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Subclass
Chalcones and dihydrochalcones
- Level 5 Retro-dihydrochalcones
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Subclass
Chalcones and dihydrochalcones
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Class
Linear 1,3-diarylpropanoids
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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
Retro-dihydrochalcones
Alternative Parents
Alkyl-phenylketones Butyrophenones Nitrobenzenes Phenoxy compounds Phenol ethers Aryl alkyl ketones Benzoyl derivatives Nitroaromatic compounds Alpha-haloketones Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Alkyl bromides Hydrocarbon derivatives Organic oxides Organic salts Organobromides Organofluorides Organonitrogen compounds Alkyl fluorides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Retro-dihydrochalcone - Alkyl-phenylketone - Butyrophenone - Nitrobenzene - Phenylketone - Nitroaromatic compound - Phenoxy compound - Benzoyl - Aryl alkyl ketone - Aryl ketone - Phenol ether - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Organic nitro compound - Ketone - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organofluoride - Organobromide - Alkyl halide - Organohalogen compound - Alkyl bromide - Organic oxygen compound - Organic oxide - Organic salt - Hydrocarbon derivative - Alkyl fluoride - Organooxygen compound - Organic nitrogen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as retro-dihydrochalcones. These are a form of normal dihydrochalcones that are structurally distinguished by the lack of oxygen functionalities at the C2'- and C6'-positions.
External Descriptors
Not available