Compound Identification
SMILES
CC1=C(COC2CCCC(C2)OS(=O)(=O)C2=C(Cl)C=CC(=C2)[N+]([O-])=O)N=C(O1)C1=CC=C(F)C=C1
InChIKey
InChIKey=BYYDHSDBIUUKPT-UHFFFAOYSA-N
Formula
C23H22ClFN2O7S
Mass
524.94
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Oxazoles
- Level 5 Phenyl-1,3-oxazoles
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Subclass
Oxazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Oxazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenyl-1,3-oxazoles
Alternative Parents
Benzenesulfonate esters Arylsulfonic acids and derivatives Benzenesulfonyl compounds Nitrobenzenes 2,4,5-trisubstituted oxazoles Nitroaromatic compounds Chlorobenzenes Fluorobenzenes Aryl fluorides Aryl chlorides Organosulfonic acid esters Heteroaromatic compounds Sulfonyls Dialkyl ethers Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organonitrogen compounds Organofluorides Hydrocarbon derivatives Organic zwitterions Organochlorides Organic oxides Organic salts
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenyl-1,3-oxazole - Benzenesulfonate ester - Benzenesulfonate - Nitrobenzene - Benzenesulfonyl group - Arylsulfonic acid or derivatives - 2,4,5-trisubstituted 1,3-oxazole - Nitroaromatic compound - Halobenzene - Fluorobenzene - Chlorobenzene - Aryl chloride - Benzenoid - Aryl fluoride - Organosulfonic acid ester - Monocyclic benzene moiety - Aryl halide - Heteroaromatic compound - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Sulfonyl - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Oxacycle - Azacycle - Dialkyl ether - Ether - Organic oxoazanium - Organic 1,3-dipolar compound - Organic zwitterion - Organohalogen compound - Organic salt - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,3-oxazoles. These are aromatic heterocyclic compounds containing a 1,3-oxazole substituted at one or more positions by a phenyl group.
External Descriptors
Not available