Compound Identification
SMILES
[O-]C1=C(C=C(Br)C=C1C=NC1=CC2=C(OC(=N2)C2=C(Cl)C(Cl)=CC=C2)C=C1)[N+]([O-])=O
InChIKey
InChIKey=JYNNVRAUYMMTPO-UHFFFAOYSA-M
Formula
C20H9BrCl2N3O4
Mass
506.11
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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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
Benzoxazoles Nitrobenzenes Dichlorobenzenes Nitroaromatic compounds Phenoxides Bromobenzenes Aryl bromides Aryl chlorides Heteroaromatic compounds Shiff bases Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Organooxygen compounds Hydrocarbon derivatives Organic oxides Organic salts Organobromides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,3-oxazole - Benzoxazole - Nitrobenzene - Nitroaromatic compound - 1,2-dichlorobenzene - Bromobenzene - Chlorobenzene - Halobenzene - Phenoxide - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Organic nitro compound - C-nitro compound - Shiff base - Oxacycle - Organic oxoazanium - Azacycle - Aldimine - Organooxygen compound - Organonitrogen compound - Imine - Organic salt - Organic nitrogen compound - Organohalogen compound - Organobromide - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organic cation - Aromatic heteropolycyclic 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