Compound Identification
SMILES
ClC1=CC=C(C=C1)C(=O)N1C(=O)OC2=C1C=CC(=C2)S(=O)(=O)N1CCCCC1
InChIKey
InChIKey=BJQHKJRZBYKDGE-UHFFFAOYSA-N
Formula
C19H17ClN2O5S
Mass
420.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzoxazoles
- Subclass Benzoxazolones
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Class
Benzoxazoles
-
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 Benzoyl derivatives Chlorobenzenes Aryl chlorides Piperidines Organosulfonamides Heteroaromatic compounds Oxazoles Sulfonyls Azacyclic compounds Oxacyclic compounds Organooxygen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazolone - 4-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Piperidine - Organosulfonic acid amide - Benzenoid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Azole - Oxazole - Heteroaromatic compound - Sulfonyl - Azacycle - Oxacycle - Organosulfur compound - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Organic nitrogen 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