Compound Identification
SMILES
CC(=O)NC1=CC=C(NC2=CC(OC3=CC=C(Br)C=C3)=C(C=C2[N+]([O-])=O)S(=O)(=O)C(F)(F)F)C=C1
InChIKey
InChIKey=QDFNSYQMNBLCGJ-UHFFFAOYSA-N
Formula
C21H15BrF3N3O6S
Mass
574.33
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Diphenylethers
- Level 5 Bromodiphenyl ethers
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Subclass
Diphenylethers
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Class
Benzene and substituted derivatives
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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
Diarylethers Sulfonylanilines Acetanilides Nitrobenzenes N-acetylarylamines Benzenesulfonyl compounds Nitroaromatic compounds Phenoxy compounds Phenol ethers Bromobenzenes Aryl bromides Primary aromatic amines Acetamides Sulfones Trihalomethanes Secondary carboxylic acid amides Amino acids and derivatives Secondary amines Propargyl-type 1,3-dipolar organic compounds Organic oxoazanium compounds Carbonyl compounds Organic salts Organic zwitterions Organobromides Organofluorides Alkyl fluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic homomonocyclic compounds
Substituents
Bromodiphenyl ether - Diaryl ether - Acetanilide - Sulfonylaniline - Nitrobenzene - N-acetylarylamine - Benzenesulfonyl group - Anilide - Phenoxy compound - Nitroaromatic compound - Phenol ether - N-arylamide - Aniline or substituted anilines - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Primary aromatic amine - Acetamide - Sulfonyl - Sulfone - Organic nitro compound - Trihalomethane - Amino acid or derivatives - Carboxamide group - Secondary carboxylic acid amide - C-nitro compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Ether - Secondary amine - Organic oxoazanium - Organosulfur compound - Organic oxygen compound - Amine - Organic nitrogen compound - Alkyl halide - Halomethane - Organic oxide - Carbonyl group - Alkyl fluoride - Organic zwitterion - Organic salt - Organohalogen compound - Hydrocarbon derivative - Organobromide - Organofluoride - Organonitrogen compound - Organooxygen compound - 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