Compound Identification
SMILES
CN(CC1=C(N=NN1C1=NON=C1N)C(=O)NN=C(C)C1=CC2=C(OCO2)C=C1)C1=CC=CC=C1
InChIKey
InChIKey=XIEOPYZDBOTODW-UHFFFAOYSA-N
Formula
C22H21N9O4
Mass
475.469
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
Aniline and substituted anilines Dialkylarylamines Aralkylamines Primary aromatic amines Imidolactams Vinylogous amides Triazoles Heteroaromatic compounds Furazans Amino acids and derivatives Acetals Oxacyclic compounds Azacyclic compounds Organic oxides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzodioxole - Tertiary aliphatic/aromatic amine - Aniline or substituted anilines - Dialkylarylamine - Aralkylamine - Monocyclic benzene moiety - Primary aromatic amine - Imidolactam - Benzenoid - Azole - Furazan - Oxadiazole - Heteroaromatic compound - Vinylogous amide - 1,2,3-triazole - Amino acid or derivatives - Tertiary amine - Oxacycle - Carboxylic acid derivative - Acetal - Azacycle - Primary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - 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