Compound Identification
SMILES
COC1=C(OCF)C=CC(=C1)C(NC1=CC=C(C=C1)C(N)=N)C1=NC(=O)N(N1)C1=NC=CC=N1
InChIKey
InChIKey=XEFYOMWMLYXTII-UHFFFAOYSA-N
Formula
C22H21FN8O3
Mass
464.461
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Phenol ethers
- Subclass Anisoles
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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
Aniline and substituted anilines Methoxybenzenes Phenoxy compounds Phenylalkylamines Alkyl aryl ethers Secondary alkylarylamines Pyrimidines and pyrimidine derivatives Heteroaromatic compounds Triazoles Carboximidamides Carboxamidines Azacyclic compounds Organofluorides Organic oxides Alkyl fluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Anisole - Phenoxy compound - Aniline or substituted anilines - Phenylalkylamine - Methoxybenzene - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Aralkylamine - Pyrimidine - Monocyclic benzene moiety - Heteroaromatic compound - 1,2,4-triazole - Azole - Azacycle - Amidine - Organoheterocyclic compound - Carboximidamide - Secondary amine - Carboxylic acid amidine - Ether - Organic oxide - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Alkyl fluoride - Organic nitrogen compound - Amine - Alkyl halide - Hydrocarbon derivative - Organic oxygen 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