Compound Identification
SMILES
CCN1C(C=CC=C2N(C)C3=CC=CC=C3C2(C)C)=[N+](CCCOC(C)=O)C2=C1C=CC=C2Cl
InChIKey
InChIKey=NLDJPISBGATOEF-UHFFFAOYSA-N
Formula
C28H33ClN3O2
Mass
479.04
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
Indoles and derivatives Tertiary alkylarylamines Aryl chlorides Benzenoids N-substituted imidazoles Heteroaromatic compounds Amino acids and derivatives Carboxylic acid esters Azacyclic compounds Monocarboxylic acids and derivatives Enamines Organopnictogen compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Indole or derivatives - Tertiary aliphatic/aromatic amine - Aryl chloride - Aryl halide - N-substituted imidazole - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Amino acid or derivatives - Tertiary amine - Carboxylic acid ester - Enamine - Carboxylic acid derivative - Azacycle - Monocarboxylic acid or derivatives - Amine - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen 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