Compound Identification
SMILES
CN1N=C(C2=C(N(C3CCCCC3)C(N)=C2C2=NC3=CC=CC=C3O2)C1=O)[N+]([O-])=O
InChIKey
InChIKey=KBYXBRGJMFTCBL-UHFFFAOYSA-N
Formula
C20H20N6O4
Mass
408.418
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Benzoxazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzoxazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Benzoxazoles
Alternative Parents
Nitroaromatic compounds Pyridazinones Substituted pyrroles Benzenoids Imidolactams Heteroaromatic compounds Oxazoles Lactams Organic oxoazanium compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Oxacyclic compounds Organooxygen compounds Organic oxides Primary amines Hydrocarbon derivatives Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoxazole - Nitroaromatic compound - Pyridazinone - Pyridazine - Imidolactam - Substituted pyrrole - Benzenoid - Azole - Oxazole - Heteroaromatic compound - Pyrrole - Lactam - C-nitro compound - Organic nitro compound - Organic oxoazanium - Oxacycle - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Amine - Primary amine - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoxazoles. These are organic compounds containing a benzene fused to an oxazole ring Oxazole is five-membered aromatic ring with a nitrogen and an oxygen atoms at the 1- and 3-position, respectively.
External Descriptors
Not available