Compound Identification
SMILES
CC1=CC2=C(C=C1)N=C(N2)C(=C\C1=CC=C(O1)C1=C(C)C(C)=C(C=C1)[N+]([O-])=O)\C#N
InChIKey
InChIKey=YAUHQMIDMSQFAN-LFIBNONCSA-N
Formula
C23H18N4O3
Mass
398.422
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
Nitrotoluenes Nitrobenzenes o-Xylenes Nitroaromatic compounds Furans Heteroaromatic compounds Imidazoles Propargyl-type 1,3-dipolar organic compounds Oxacyclic compounds Azacyclic compounds Organic oxoazanium compounds Nitriles Organic oxides Organic salts Hydrocarbon derivatives Organic zwitterions Organooxygen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzimidazole - Nitrobenzene - Nitrotoluene - Nitroaromatic compound - O-xylene - Xylene - Monocyclic benzene moiety - Benzenoid - Azole - Furan - Imidazole - Heteroaromatic compound - C-nitro compound - Organic nitro compound - Carbonitrile - Nitrile - Oxacycle - Organic oxoazanium - Azacycle - Allyl-type 1,3-dipolar organic compound - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Organopnictogen compound - Organic oxygen compound - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Organic zwitterion - Cyanide - Organic oxide - Organic nitrogen compound - Organic salt - 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