Compound Identification
SMILES
O=C(NC1=CC2=C(OCO2)C=C1)[C@H]1CCCN(C1)C1=NN=C(C=C1)C1=CC=CO1
InChIKey
InChIKey=MUHLEQMHKUJISG-AWEZNQCLSA-N
Formula
C21H20N4O4
Mass
392.415
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
Piperidinecarboxamides N-arylamides Dialkylarylamines Aminopyridazines Imidolactams Benzenoids Heteroaromatic compounds Furans Secondary carboxylic acid amides Oxacyclic compounds Acetals Azacyclic compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - 3-piperidinecarboxamide - Piperidinecarboxamide - Dialkylarylamine - N-arylamide - Aminopyridazine - Piperidine - Imidolactam - Benzenoid - Pyridazine - Furan - Heteroaromatic compound - Carboxamide group - Secondary carboxylic acid amide - Acetal - Carboxylic acid derivative - Oxacycle - Azacycle - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Organopnictogen compound - Carbonyl group - Organooxygen compound - Hydrocarbon derivative - Organic oxygen 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