Compound Identification
SMILES
COC1=CC=C(CNC(=O)OC2=CN=C(NC3=CC(Cl)=CC=C3)N=C2C(F)(F)F)C=C1
InChIKey
InChIKey=CKZSMOJJIUMCDZ-UHFFFAOYSA-N
Formula
C20H16ClF3N4O3
Mass
452.82
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 Aniline and substituted anilines Methoxybenzenes Alkyl aryl ethers Aminopyrimidines and derivatives Chlorobenzenes Aryl chlorides Heteroaromatic compounds Carbamate esters Azacyclic compounds Secondary amines Organic oxides Carbonyl compounds Organochlorides Organofluorides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenoxy compound - Anisole - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Aminopyrimidine - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Pyrimidine - Carbamic acid ester - Heteroaromatic compound - Azacycle - Organoheterocyclic compound - Secondary amine - Ether - Amine - Organohalogen compound - Organochloride - Hydrocarbon derivative - Carbonyl group - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Organic oxide - Organic oxygen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteromonocyclic 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