Compound Identification
SMILES
CC(C)(C)C1=CC=CC=C1NC(NC1=CC2=C(NC(=O)O2)C=C1)=NC(=O)C1=CC=C(Br)C=C1
InChIKey
InChIKey=KULWOAIEMOUICF-UHFFFAOYSA-N
Formula
C25H23BrN4O3
Mass
507.388
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzoxazoles
- Subclass Benzoxazolones
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Class
Benzoxazoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazoles
Subclass
Benzoxazolones
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazolones
Alternative Parents
4-halobenzoic acids and derivatives Phenylpropanes Benzoyl derivatives Acylguanidines Bromobenzenes Aryl bromides Oxazoles Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Carboxylic acids and derivatives Organobromides Organic oxides Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoxazolone - Phenylpropane - Benzoic acid or derivatives - Benzoyl - Halobenzene - Acylguanidine - Bromobenzene - Benzenoid - Aryl halide - Aryl bromide - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Oxazole - Guanidine - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Organic oxide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organobromide - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazolones. These are organic compounds containing a benzene fused to an oxazole ring (a five-member aliphatic ring with three carbon atoms, one oxygen atom, and one nitrogen atom) bearing a ketone group.
External Descriptors
Not available