Compound Identification
SMILES
COC1=CC=CC(=C1)C1NNC2OC(N)=C(C#N)C(C12)C1=CC(Br)=CC(Br)=C1OC
InChIKey
InChIKey=XTDAGGVISKJVCP-UHFFFAOYSA-N
Formula
C21H20Br2N4O3
Mass
536.224
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenol ethers
- Subclass Anisoles
-
Class
Phenol ethers
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Phenol ethers
Subclass
Anisoles
Intermediate Tree Nodes
Not available
Direct Parent
Anisoles
Alternative Parents
Phenoxy compounds Methoxybenzenes Bromobenzenes Alkyl aryl ethers Aryl bromides Pyrazolidines Ketene acetals Oxacyclic compounds Nitriles Azacyclic compounds Alkylhydrazines Organopnictogen compounds Organobromides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Monocyclic benzene moiety - Pyrazolidine - Ketene acetal or derivatives - Alkylhydrazine - Ether - Oxacycle - Azacycle - Carbonitrile - Nitrile - Organoheterocyclic compound - Hydrazine derivative - Organic oxygen compound - Amine - Hydrocarbon derivative - Organopnictogen compound - Organic nitrogen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Cyanide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as anisoles. These are organic compounds containing a methoxybenzene or a derivative thereof.
External Descriptors
Not available