Compound Identification
SMILES
CCN1C(N)=[N+](CC(O)C2=CC=C(Cl)C=C2)C2=CC=CC=C12
InChIKey
InChIKey=ZSEPWAPGCKEZFW-UHFFFAOYSA-O
Formula
C17H19ClN3O
Mass
316.81
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
Chlorobenzenes N-substituted imidazoles Aryl chlorides Aminoimidazoles Heteroaromatic compounds Secondary alcohols Azacyclic compounds Primary amines Organochlorides Hydrocarbon derivatives Aromatic alcohols Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Chlorobenzene - Halobenzene - Aminoimidazole - Aryl chloride - Aryl halide - Benzenoid - Monocyclic benzene moiety - N-substituted imidazole - Heteroaromatic compound - Azole - Imidazole - Secondary alcohol - Azacycle - Alcohol - Amine - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary amine - Aromatic alcohol - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic cation - 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