Compound Identification
SMILES
O=C1C2=NC=C3CCNC(C=C1NCC1=CC4=C(OCO4)C=C1)=C23
InChIKey
InChIKey=UINXCVXHYGAWEM-UHFFFAOYSA-N
Formula
C18H15N3O3
Mass
321.336
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
Indoles and derivatives Tetrahydropyridines Aralkylamines Benzenoids Ketones Ketimines Oxacyclic compounds Enamines Dialkylamines Acetals Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Hydrocarbon derivatives Aldehydes Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Indole or derivatives - Tetrahydropyridine - Aralkylamine - Benzenoid - Ketimine - Ketone - Acetal - Secondary aliphatic amine - Enamine - Secondary amine - Oxacycle - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organic oxide - Organopnictogen compound - Organic oxygen compound - Imine - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Aldehyde - Amine - 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