Compound Identification
SMILES
OC1COC(C(O)C1O)C1=NC2=C(N1)C=C(Cl)C=C2
InChIKey
InChIKey=JUNOYDUSRFMJIH-UHFFFAOYSA-N
Formula
C12H13ClN2O4
Mass
284.7
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
Oxanes Benzenoids Aryl chlorides Imidazoles Heteroaromatic compounds Secondary alcohols Polyols Oxacyclic compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Aryl chloride - Aryl halide - Oxane - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Secondary alcohol - Dialkyl ether - Ether - Oxacycle - Azacycle - Polyol - Organohalogen compound - Organic nitrogen compound - Alcohol - Hydrocarbon derivative - Organochloride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organopnictogen compound - 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