Compound Identification
SMILES
[O-][N+](=O)C1=CC=C(C=C1)[C@H](Br)[C@H](Br)C(=O)C1=CC=C(C=C1)C1=CC=CC=C1
InChIKey
InChIKey=MBTSUOGHHPLZHK-PMACEKPBSA-N
Formula
C21H15Br2NO3
Mass
489.163
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Phenylpropanoids and polyketides
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Class
Diarylheptanoids
- Subclass Linear diarylheptanoids
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Class
Diarylheptanoids
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Superclass
Phenylpropanoids and polyketides
Kingdom
Organic compounds
Superclass
Phenylpropanoids and polyketides
Class
Diarylheptanoids
Subclass
Linear diarylheptanoids
Intermediate Tree Nodes
Not available
Direct Parent
Linear diarylheptanoids
Alternative Parents
Retro-dihydrochalcones Alkyl-phenylketones Biphenyls and derivatives Butyrophenones Nitrobenzenes Aryl alkyl ketones Benzoyl derivatives Nitroaromatic compounds Alpha-haloketones Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organobromides Organonitrogen compounds Alkyl bromides Organic oxides Organic cations
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Linear 1,7-diphenylheptane skeleton - Retro-dihydrochalcone - Linear 1,3-diarylpropanoid - Alkyl-phenylketone - Biphenyl - Butyrophenone - Phenylketone - Nitrobenzene - Benzoyl - Aryl alkyl ketone - Aryl ketone - Nitroaromatic compound - Monocyclic benzene moiety - Benzenoid - Alpha-haloketone - Organic nitro compound - C-nitro compound - Ketone - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Alkyl bromide - Alkyl halide - Organobromide - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Organic salt - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as linear diarylheptanoids. These are diarylheptanoids with an open heptane chain. The two aromatic rings are linked only by the heptane chain.
External Descriptors
Not available