Compound Identification
SMILES
[O-][N+](=O)C1=C\C(=C\NC2=CC(=O)\C(C=C2)=C2\NC3=CC=CC=C3O2)C(=O)C=C1
InChIKey
InChIKey=AVGNFWAUKVQIDQ-VHYDTLJKSA-N
Formula
C20H13N3O5
Mass
375.34
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
O-quinomethanes Benzenoids Vinylogous esters Vinylogous amides C-nitro compounds Ketene acetals Organic oxoazanium compounds Oxacyclic compounds Allylamines Enamines Dialkylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic salts Organic oxides Hydrocarbon derivatives Aldehydes Organic zwitterions Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazoline - O-quinomethane - Quinomethane - Benzenoid - Vinylogous amide - Vinylogous ester - Ketene acetal or derivatives - Ketone - C-nitro compound - Cyclic ketone - Organic nitro compound - Oxacycle - Azacycle - Allylamine - Secondary aliphatic amine - Enamine - Organic oxoazanium - Secondary amine - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Organooxygen compound - Organopnictogen compound - Carbonyl group - Organic nitrogen compound - Organic zwitterion - Organic oxide - Aldehyde - Amine - 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