Compound Identification
SMILES
[K+].CCC(=CC1=[N+](CCCS([O-])(=O)=O)C2=C(O1)C=CC(NC(=O)C1=CC=CO1)=C2)C=C1OC2=C(C=C(F)C=C2)N1CCCS(O)(=O)=O
InChIKey
InChIKey=NRQBMZPGMKWREP-UHFFFAOYSA-N
Formula
C30H30FKN3O10S2
Mass
714.8
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
Benzoxazoles 2-heteroaryl carboxamides Furancarboxamides Aryl fluorides Benzenoids Sulfonyls Oxazoles Alkanesulfonic acids Organosulfonic acids Heteroaromatic compounds Secondary carboxylic acid amides Ketene acetals Organic metal halides Azacyclic compounds Oxacyclic compounds Organic oxides Organic potassium salts Organofluorides Amines Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazole - Benzoxazoline - 2-heteroaryl carboxamide - Furoic acid or derivatives - Furancarboxamide - Aryl fluoride - Aryl halide - Benzenoid - Azole - Furan - Oxazole - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Organosulfonic acid - Sulfonyl - Alkanesulfonic acid - Heteroaromatic compound - Secondary carboxylic acid amide - Carboxamide group - Ketene acetal or derivatives - Carboxylic acid derivative - Organic metal halide - Oxacycle - Azacycle - Organic alkali metal salt - Organic oxide - Amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Organosulfur compound - Hydrocarbon derivative - Organic salt - Organic potassium salt - Organic nitrogen compound - Organic oxygen compound - Organic cation - 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