Compound Identification
SMILES
NC1=C(CC2=CC3=C(OCO3)C=C2)C(=O)NN1
InChIKey
InChIKey=QBIUGDQTXGHUPX-UHFFFAOYSA-N
Formula
C11H11N3O3
Mass
233.227
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
Pyrazolones Benzenoids Vinylogous amides Pyrazoles Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Acetals Primary amines Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Pyrazolinone - Benzenoid - Azole - Pyrazole - Vinylogous amide - Heteroaromatic compound - Lactam - Azacycle - Oxacycle - Acetal - Organopnictogen compound - Organic oxygen compound - Amine - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - 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