Compound Identification
SMILES
C\C(Br)=C/C=C/C(O)CC1=NC(C=O)=CO1
InChIKey
InChIKey=AUKVFLZIGYEXSN-BVOBWIRXSA-N
Formula
C11H12BrNO3
Mass
286.125
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Oxazoles
- Level 5 2,4-disubstituted oxazoles
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Subclass
Oxazoles
-
Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Oxazoles
Intermediate Tree Nodes
Not available
Direct Parent
2,4-disubstituted oxazoles
Alternative Parents
Aryl-aldehydes Heteroaromatic compounds Secondary alcohols Vinyl bromides Oxacyclic compounds Bromoalkenes Azacyclic compounds Organonitrogen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2,4-disubstituted 1,3-oxazole - Aryl-aldehyde - Heteroaromatic compound - Secondary alcohol - Vinyl bromide - Vinyl halide - Haloalkene - Bromoalkene - Azacycle - Oxacycle - Alcohol - Organic nitrogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic oxide - Aldehyde - Organohalogen compound - Organobromide - Hydrocarbon derivative - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 2,4-disubstituted oxazoles. These are compounds containing an oxazole ring substituted at positions 2 and 4 only. Oxazole is a five-membered aromatic heterocycle with one oxygen, one nitrogen, and three carbon atoms. Isomers include 1,2-oxazole and 1,3-oxazole.
External Descriptors
Not available