Compound Identification
SMILES
CCC(=CC1=[N+](CCCS(O)(=O)=O)C2=C(O1)C=CC(Cl)=C2)C=C1OC2=C(C=C(Cl)C=C2)N1CCCS(O)(=O)=O
InChIKey
InChIKey=UWIGBSIQSANNEV-UHFFFAOYSA-O
Formula
C25H27Cl2N2O8S2
Mass
618.52
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 Benzenoids Aryl chlorides Sulfonyls Oxazoles Organosulfonic acids Heteroaromatic compounds Alkanesulfonic acids Ketene acetals Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazoline - Benzoxazole - Benzenoid - Aryl halide - Aryl chloride - Heteroaromatic compound - Alkanesulfonic acid - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Oxazole - Azole - Ketene acetal or derivatives - Oxacycle - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen 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