Compound Identification
SMILES
FC1=NN2C(CNC(=O)C3=CC=CC=C3)=C(N=C2C=C1)C1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=LLEXCQKWEUVYCL-UHFFFAOYSA-N
Formula
C21H15FN4O3
Mass
390.374
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
Benzamides Benzoyl derivatives Pyridazines and derivatives N-substituted imidazoles Aryl fluorides Heteroaromatic compounds Secondary carboxylic acid amides Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzamide - Benzodioxole - Benzoic acid or derivatives - Benzoyl - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Benzenoid - Pyridazine - N-substituted imidazole - Azole - Heteroaromatic compound - Imidazole - Secondary carboxylic acid amide - Carboxamide group - Acetal - Oxacycle - Azacycle - Carboxylic acid derivative - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organonitrogen compound - Organic oxygen compound - Organofluoride - Organohalogen 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