Compound Identification
SMILES
OC1=CC(Cl)=C2O\C(NC2=C1)=C1/C=CC(=O)C(Cl)=C1
InChIKey
InChIKey=WTNXIAPDLBMMCM-AWNIVKPZSA-N
Formula
C13H7Cl2NO3
Mass
296.1
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazolines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazolines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazolines
Alternative Parents
P-quinomethanes Halophenols 1-hydroxy-2-unsubstituted benzenoids Aryl chlorides Alpha-chloroketones Ketene acetals Vinyl chlorides Oxacyclic compounds Chloroalkenes Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazoline - 3-halophenol - P-quinomethane - Quinomethane - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Aryl chloride - Aryl halide - Benzenoid - Alpha-haloketone - Alpha-chloroketone - Ketene acetal or derivatives - Ketone - Cyclic ketone - Vinyl chloride - Chloroalkene - Azacycle - Oxacycle - Haloalkene - Vinyl halide - Organooxygen compound - Organochloride - Organohalogen compound - Amine - Hydrocarbon derivative - Carbonyl group - Organic oxide - Organic oxygen compound - Organonitrogen compound - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazolines. These are organic compounds containing a benzene ring fused to an oxazoline ring. Oxazoline is five-membered unsaturated ring with a nitrogen atom and an oxygen atom at the 1- and 3-position, respectively. Additionally, it contains two double bonds.
External Descriptors
Not available