Compound Identification
SMILES
CCOC1=CC=CC(=CNC2=CC3=C(OC(CC4=CC=C(Cl)C=C4)=N3)C=C2)C1=O
InChIKey
InChIKey=IZSZNBAURARQTL-UHFFFAOYSA-N
Formula
C23H19ClN2O3
Mass
406.87
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazoles
Alternative Parents
O-quinomethanes Chlorobenzenes Aryl chlorides Oxazoles Vinylogous amides Heteroaromatic compounds Oxacyclic compounds Enamines Azacyclic compounds Allylamines Secondary amines Organopnictogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazole - O-quinomethane - Quinomethane - Halobenzene - Chlorobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Oxazole - Vinylogous amide - Ketone - Cyclic ketone - Oxacycle - Allylamine - Secondary amine - Azacycle - Enamine - Aldehyde - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazoles. These are organic compounds containing a benzene fused to an oxazole ring Oxazole is five-membered aromatic ring with a nitrogen and an oxygen atoms at the 1- and 3-position, respectively.
External Descriptors
Not available