Compound Identification
SMILES
COC1=CC(=CC=C2NC3=C(O2)C=CC(=C3)[N+]([O-])=O)C=C(Cl)C1=O
InChIKey
InChIKey=WINMWQVWNRJBEA-UHFFFAOYSA-N
Formula
C16H11ClN2O5
Mass
346.72
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 Nitroaromatic compounds Benzenoids Alpha-chloroketones Ketene acetals Vinyl chlorides Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Chloroalkenes Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Amines Organochlorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazoline - Nitroaromatic compound - P-quinomethane - Quinomethane - Benzenoid - Alpha-haloketone - Alpha-chloroketone - Ketene acetal or derivatives - Ketone - C-nitro compound - Organic nitro compound - Cyclic ketone - Organic oxoazanium - Oxacycle - Azacycle - Vinyl chloride - Vinyl halide - Chloroalkene - Haloalkene - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic oxide - Organic zwitterion - Hydrocarbon derivative - Organohalogen compound - Amine - Organochloride - Organic salt - 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