Compound Identification
SMILES
COC(=O)C1=C(C)NC(C(=O)[C@H](C)[N+]2=CN(C=C)C3=CC=CC=C23)=C1C
InChIKey
InChIKey=QCBVYIBBQUSQBK-AWEZNQCLSA-O
Formula
C20H22N3O3
Mass
352.413
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
Pyrrole carboxylic acids and derivatives Aryl alkyl ketones Substituted pyrroles N-substituted imidazoles Benzenoids Vinylogous amides Methyl esters Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Pyrrole-3-carboxylic acid or derivatives - Aryl ketone - Aryl alkyl ketone - N-substituted imidazole - Substituted pyrrole - Benzenoid - Azole - Imidazole - Pyrrole - Methyl ester - Heteroaromatic compound - Vinylogous amide - Ketone - Carboxylic acid ester - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organic oxide - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - 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