Compound Identification
SMILES
CC1=CC2=C(O\C(N2)=C2/C=C(NC(=O)C3=CC(=CC=C3)[N+]([O-])=O)C=CC2=O)C=C1
InChIKey
InChIKey=SLHPWFMEUZAUEL-LTGZKZEYSA-N
Formula
C21H15N3O5
Mass
389.367
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
Benzamides Nitrobenzenes Benzoyl derivatives Nitroaromatic compounds O-quinomethanes Vinylogous esters Vinylogous amides Secondary carboxylic acid amides Ketene acetals Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Organic oxoazanium compounds Organonitrogen compounds Organopnictogen compounds Hydrocarbon derivatives Organic zwitterions Organic salts Organic oxides Aldehydes
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzamide - Benzoic acid or derivatives - Benzoxazoline - Nitrobenzene - Nitroaromatic compound - Benzoyl - O-quinomethane - Quinomethane - Monocyclic benzene moiety - Benzenoid - Vinylogous ester - Vinylogous amide - Carboxamide group - Ketene acetal or derivatives - Ketone - C-nitro compound - Organic nitro compound - Secondary carboxylic acid amide - Cyclic ketone - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Oxacycle - Azacycle - Organic oxoazanium - Organic nitrogen compound - Organic salt - Aldehyde - Carbonyl group - Organic oxygen compound - Organic zwitterion - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Organopnictogen 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