Compound Identification
SMILES
OCC(O)=O.CC(NCC1=CC=CC=C1)C1=NC2=CC=CC=C2N1
InChIKey
InChIKey=JZOPCRSKUCGUPU-UHFFFAOYSA-N
Formula
C18H21N3O3
Mass
327.384
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
Phenylmethylamines Benzylamines Aralkylamines Alpha hydroxy acids and derivatives Imidazoles Heteroaromatic compounds Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Primary alcohols Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Not available
Substituents
Benzimidazole - Benzylamine - Phenylmethylamine - Aralkylamine - Alpha-hydroxy acid - Benzenoid - Monocyclic benzene moiety - Hydroxy acid - Heteroaromatic compound - Azole - Imidazole - Azacycle - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Primary alcohol - Amine - Alcohol - 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