Compound Identification
SMILES
OCCN1CCN(CC2=NC3=C(N2)C=C(C=C3)[N+]([O-])=O)CC1
InChIKey
InChIKey=DRVOQCPINLFBMT-UHFFFAOYSA-N
Formula
C14H19N5O3
Mass
305.338
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
Nitroaromatic compounds Aralkylamines N-alkylpiperazines Benzenoids Heteroaromatic compounds Imidazoles Trialkylamines 1,2-aminoalcohols Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic oxides Organic zwitterions Primary alcohols Hydrocarbon derivatives Organic salts
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Nitroaromatic compound - N-alkylpiperazine - Aralkylamine - 1,4-diazinane - Piperazine - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Organic nitro compound - 1,2-aminoalcohol - C-nitro compound - Tertiary amine - Tertiary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Alkanolamine - Azacycle - Organic oxoazanium - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic salt - Alcohol - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organic zwitterion - Primary alcohol - Amine - 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