Compound Identification
SMILES
C(OC1=NN=C(C=C1)N1C=CN=C1)C1CCCCN1CC1=CC2=C(OCO2)C=C1
InChIKey
InChIKey=SHENZBUVQQVDFC-UHFFFAOYSA-N
Formula
C21H23N5O3
Mass
393.447
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
Aralkylamines Alkyl aryl ethers Pyridazines and derivatives Piperidines N-substituted imidazoles Benzenoids Heteroaromatic compounds Trialkylamines Oxacyclic compounds Azacyclic compounds Acetals Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Alkyl aryl ether - Aralkylamine - N-substituted imidazole - Piperidine - Benzenoid - Pyridazine - Azole - Imidazole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Acetal - Ether - Oxacycle - Azacycle - Hydrocarbon derivative - Organic nitrogen compound - Organopnictogen compound - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen 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