Compound Identification
SMILES
COC1=C(OCC2=CC=C(F)C=C2)C(Br)=CC(=C1)C1C2=C(C)NN=C2OC(N)=C1C#N
InChIKey
InChIKey=YUKWGGABJLODLU-UHFFFAOYSA-N
Formula
C22H18BrFN4O3
Mass
485.313
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 Alkyl aryl ethers Bromobenzenes Fluorobenzenes Aryl bromides Aryl fluorides Pyrazoles Heteroaromatic compounds Ketene acetals Oxacyclic compounds Nitriles Azacyclic compounds Organobromides Organofluorides Organopnictogen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - Anisole - Methoxybenzene - Alkyl aryl ether - Bromobenzene - Fluorobenzene - Halobenzene - Aryl bromide - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Azole - Pyrazole - Ketene acetal or derivatives - Oxacycle - Azacycle - Organoheterocyclic compound - Ether - Carbonitrile - Nitrile - Organooxygen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organonitrogen compound - Organofluoride - Cyanide - Hydrocarbon derivative - Organohalogen compound - Organobromide - 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