Compound Identification
SMILES
CC(C)N1C=C(C2=C1N=CN=C2N)C1=CC=C(OC2=C(C=C(C=C2)[N+]([O-])=O)C(C)=O)C=C1
InChIKey
InChIKey=MLLRMMJCUIDKEL-UHFFFAOYSA-N
Formula
C23H21N5O4
Mass
431.452
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Diphenylethers
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Diphenylethers
Intermediate Tree Nodes
Not available
Direct Parent
Diphenylethers
Alternative Parents
Alkyl-phenylketones Phenylpyrroles Diarylethers Pyrrolo[2,3-d]pyrimidines Acetophenones Nitrobenzenes Aryl alkyl ketones Benzoyl derivatives Phenoxy compounds Nitroaromatic compounds Phenol ethers Aminopyrimidines and derivatives Imidolactams Heteroaromatic compounds Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Hydrocarbon derivatives Primary amines Organic oxides Organic salts Organic zwitterions
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl-phenylketone - Diphenylether - 3-phenylpyrrole - Diaryl ether - Acetophenone - Pyrrolopyrimidine - Nitrobenzene - Pyrrolo[2,3-d]pyrimidine - Phenylketone - Phenoxy compound - Nitroaromatic compound - Phenol ether - Aryl ketone - Aryl alkyl ketone - Benzoyl - Aminopyrimidine - Substituted pyrrole - Pyrimidine - Imidolactam - Heteroaromatic compound - Pyrrole - C-nitro compound - Organic nitro compound - Ketone - Ether - Azacycle - Organoheterocyclic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic salt - Organic oxygen compound - Amine - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Primary amine - Organic nitrogen compound - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether group.
External Descriptors
Not available