Compound Identification
SMILES
COC1=C(COC2=C(Cl)C=C(Br)C=C2)C=C(C=C1)[C@H]1[C@@H]2CCCC=C2C(C#N)=C(N)C1(C#N)C#N
InChIKey
InChIKey=CUSLXIGCUBZMSO-NLFFAJNJSA-N
Formula
C27H22BrClN4O2
Mass
549.85
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 Chlorobenzenes Bromobenzenes Alkyl aryl ethers Aryl chlorides Aryl bromides Nitriles Enamines Organochlorides Organobromides Monoalkylamines Hydrocarbon derivatives
Molecular Framework
Aromatic homopolycyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Chlorobenzene - Halobenzene - Aryl bromide - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Enamine - Ether - Carbonitrile - Nitrile - Organobromide - Amine - Organic nitrogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Cyanide - Primary aliphatic amine - Organic oxygen compound - Organohalogen compound - Aromatic homopolycyclic 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