Compound Identification
SMILES
[Na+].CCC1=NC2=C(F)C=C(F)C=C2N1C1=CC=CC2=C1OC[C@H]2NC1=CC2=C(C=C1)[C@H](CC([O-])=O)CO2
InChIKey
InChIKey=KRFYTFUZYKQJHR-DXPOFMJKSA-M
Formula
C27H22F2N3NaO4
Mass
513.477
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzimidazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzimidazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzimidazoles
Alternative Parents
Coumarans Secondary alkylarylamines Alkyl aryl ethers Aralkylamines Aryl fluorides Benzenoids N-substituted imidazoles Heteroaromatic compounds Carboxylic acid salts Amino acids Monocarboxylic acids and derivatives Oxacyclic compounds Carboxylic acids Azacyclic compounds Organic metal halides Hydrocarbon derivatives Organic oxides Carbonyl compounds Organic sodium salts Organic zwitterions Organofluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Coumaran - Benzimidazole - Alkyl aryl ether - Aralkylamine - Secondary aliphatic/aromatic amine - Aryl fluoride - Aryl halide - N-substituted imidazole - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Amino acid or derivatives - Amino acid - Carboxylic acid salt - Organic metal halide - Oxacycle - Carboxylic acid derivative - Azacycle - Carboxylic acid - Ether - Organic alkali metal salt - Monocarboxylic acid or derivatives - Secondary amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organic oxygen compound - Amine - Organic sodium salt - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic salt - Carbonyl group - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
External Descriptors
Not available