Compound Identification
SMILES
CC1=CC(CC2=NN3C(C=C2)=NC=C3C2=CC3=C(OCO3)C=C2)=CC=C1
InChIKey
InChIKey=OAXDMGMSHTZXDK-UHFFFAOYSA-N
Formula
C21H17N3O2
Mass
343.386
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzodioxoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzodioxoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzodioxoles
Alternative Parents
Toluenes Pyridazines and derivatives N-substituted imidazoles Heteroaromatic compounds Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Toluene - Monocyclic benzene moiety - N-substituted imidazole - Pyridazine - Benzenoid - Azole - Imidazole - Heteroaromatic compound - Azacycle - Acetal - Oxacycle - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organopnictogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzodioxoles. These are organic compounds containing a benzene ring fused to either isomers of dioxole. Dioxole is a five-membered unsaturated ring of two oxygen atoms and three carbon atoms.
External Descriptors
Not available