Compound Identification
SMILES
COC1=CC(=CC(Cl)=C2NC3=CC=CC=C3O2)C=C(C1=O)[N+]([O-])=O
InChIKey
InChIKey=MQOIRJYOJDFACI-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 Benzenoids C-nitro compounds Vinyl chlorides Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Chloroalkenes Azacyclic compounds Organochlorides Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazoline - P-quinomethane - Quinomethane - Benzenoid - Ketone - C-nitro compound - Cyclic ketone - Organic nitro compound - Organic oxoazanium - Oxacycle - Vinyl chloride - Vinyl halide - Azacycle - Chloroalkene - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Haloalkene - Hydrocarbon derivative - Organooxygen compound - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Organic zwitterion - Organic oxide - Organohalogen compound - Amine - Organochloride - Organic salt - Organonitrogen 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