Compound Identification
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.[2H]C([2H])([2H])NC(=O)C1=NC=CC(OC2=CC(F)=C(NC(=O)NC3=CC(=C(Cl)C=C3)C(F)(F)F)C=C2)=C1
InChIKey
InChIKey=WAVSRQWQQKBJEZ-NIIDSAIPSA-N
Formula
C28H23ClF4N4O6S
Mass
658.04
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organic oxygen compounds
-
Class
Organooxygen compounds
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Subclass
Ethers
- Level 5 Diarylethers
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Subclass
Ethers
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Class
Organooxygen compounds
-
Superclass
Organic oxygen compounds
Kingdom
Organic compounds
Superclass
Organic oxygen compounds
Class
Organooxygen compounds
Subclass
Ethers
Intermediate Tree Nodes
Not available
Direct Parent
Diarylethers
Alternative Parents
p-Methylbenzenesulfonates Trifluoromethylbenzenes Tosyl compounds N-phenylureas Benzenesulfonyl compounds Pyridinecarboxamides 1-sulfo,2-unsubstituted aromatic compounds Phenoxy compounds Phenol ethers 2-heteroaryl carboxamides Chlorobenzenes Fluorobenzenes Aryl chlorides Aryl fluorides Sulfonyls Heteroaromatic compounds Organosulfonic acids Secondary carboxylic acid amides Ureas Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organochlorides Organofluorides Alkyl fluorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Not available
Substituents
P-methylbenzenesulfonate - Diaryl ether - Benzenesulfonate - Tosyl compound - N-phenylurea - Trifluoromethylbenzene - Benzenesulfonyl group - Pyridinecarboxamide - Pyridine carboxylic acid or derivatives - Arylsulfonic acid or derivatives - 1-sulfo,2-unsubstituted aromatic compound - Phenol ether - 2-heteroaryl carboxamide - Phenoxy compound - Fluorobenzene - Halobenzene - Toluene - Chlorobenzene - Aryl chloride - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridine - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Heteroaromatic compound - Urea - Secondary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Carboxylic acid derivative - Alkyl halide - Organic oxide - Organopnictogen compound - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Alkyl fluoride - Organic nitrogen compound - Organochloride - Organofluoride - Organonitrogen compound - Organosulfur compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as diarylethers. These are organic compounds containing the dialkyl ether functional group, with the formula ROR', where R and R' are aryl groups.
External Descriptors
Not available