Compound Identification
SMILES
COC(=O)CN1C(=O)N(C)C(=O)N(C1=O)C1=C(Br)C=CC(OC2=C(F)C=C(C=C2Cl)C(F)(F)F)=C1
InChIKey
InChIKey=WNKGDNGTTHLFAM-UHFFFAOYSA-N
Formula
C20H13BrClF4N3O6
Mass
582.69
Taxonomic Classification
Taxonomy Tree
-
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
Alpha amino acid esters Diarylethers Trifluoromethylbenzenes Phenoxy compounds Phenol ethers Bromobenzenes Triazinones Chlorobenzenes Fluorobenzenes 1,3,5-triazines Aryl bromides Aryl chlorides Aryl fluorides Heteroaromatic compounds Methyl esters Ureas Azacyclic compounds Monocarboxylic acids and derivatives Carbonyl compounds Hydrocarbon derivatives Organic oxides Organobromides Organochlorides Organofluorides Alkyl fluorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Bromodiphenyl ether - Alpha-amino acid ester - Diaryl ether - Alpha-amino acid or derivatives - Trifluoromethylbenzene - Phenoxy compound - Phenol ether - Halobenzene - Fluorobenzene - Triazinone - Bromobenzene - Chlorobenzene - 1,3,5-triazine - Triazine - Aryl halide - Aryl fluoride - Aryl chloride - Aryl bromide - Heteroaromatic compound - Methyl ester - Carboxylic acid ester - Urea - Azacycle - Monocarboxylic acid or derivatives - Organoheterocyclic compound - Carboxylic acid derivative - Ether - Organochloride - Organooxygen compound - Organonitrogen compound - Carbonyl group - Alkyl halide - Organofluoride - Organohalogen compound - Alkyl fluoride - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organobromide - Aromatic heteromonocyclic 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