Compound Identification
SMILES
C\C(=C(/NC(=O)C1=CC=CC=C1)C(O)=O)C1=CC=C(OC2=CC=CC=C2Br)C=C1
InChIKey
InChIKey=DXVJXBAHRYEWPG-RCCKNPSSSA-N
Formula
C23H18BrNO4
Mass
452.304
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Diphenylethers
- Level 5 Bromodiphenyl ethers
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Subclass
Diphenylethers
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Diphenylethers
Intermediate Tree Nodes
Not available
Direct Parent
Bromodiphenyl ethers
Alternative Parents
N-acyl-alpha amino acids Hippuric acids Cinnamic acids Diarylethers Phenylpropenes Phenoxy compounds Phenol ethers Benzoyl derivatives Bromobenzenes Aryl bromides Secondary carboxylic acid amides Carboxylic acids Monocarboxylic acids and derivatives Organonitrogen compounds Carbonyl compounds Organic oxides Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Bromodiphenyl ether - Hippuric acid or derivatives - N-acyl-alpha amino acid or derivatives - N-acyl-alpha-amino acid - Hippuric acid - Cinnamic acid - Cinnamic acid or derivatives - Diaryl ether - Alpha-amino acid or derivatives - Benzamide - Benzoic acid or derivatives - Phenylpropene - Phenoxy compound - Benzoyl - Phenol ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Secondary carboxylic acid amide - Carboxamide group - Monocarboxylic acid or derivatives - Ether - Carboxylic acid - Carboxylic acid derivative - Organohalogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organobromide - Aromatic homomonocyclic compound
Description
This compound belongs to the class of organic compounds known as bromodiphenyl ethers. These are compounds that contain two benzene groups linked to each other via an ether bond, and where at least one ring is substituted with a bromo group.
External Descriptors
Not available