Compound Identification
SMILES
OCC(CO)OC1=C(Cl)C=C(C2=NOC(=N2)C2=CN3C=C(C=C(Cl)C3=N2)C(F)(F)F)C(Cl)=C1
InChIKey
InChIKey=XPYCAJLNWSMWLF-UHFFFAOYSA-N
Formula
C19H12Cl3F3N4O4
Mass
523.67
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
-
Subclass
Oxadiazoles
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Level 5
1,2,4-oxadiazoles
- Level 6 Phenyloxadiazoles
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Level 5
1,2,4-oxadiazoles
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Subclass
Oxadiazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Oxadiazoles
Intermediate Tree Nodes
1,2,4-oxadiazoles
Direct Parent
Phenyloxadiazoles
Alternative Parents
Imidazo[1,2-a]pyridines Imidazopyridines Dichlorobenzenes Phenoxy compounds Phenol ethers Alkyl aryl ethers Pyridines and derivatives Aryl chlorides N-substituted imidazoles Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Organonitrogen compounds Hydrocarbon derivatives Primary alcohols Alkyl fluorides Organochlorides Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-oxadiazole - Imidazopyridine - Imidazo[1,2-a]pyridine - Phenol ether - 1,4-dichlorobenzene - Phenoxy compound - Chlorobenzene - Alkyl aryl ether - Halobenzene - Monocyclic benzene moiety - Benzenoid - Pyridine - N-substituted imidazole - Aryl halide - Aryl chloride - Heteroaromatic compound - Imidazole - Oxacycle - Azacycle - Ether - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Primary alcohol - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organic oxygen compound - Alkyl halide - Organofluoride - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyloxadiazoles. These are polycyclic aromatic compounds containing a benzene ring linked to a 1,2,4-oxadiazole ring through a CC or CN bond.
External Descriptors
Not available