Compound Identification
SMILES
COC1=CC=CC(CCN2[C@@H](CCN3C(=O)C=C(N=C23)N2CCOCC2)C(F)(F)F)=C1
InChIKey
InChIKey=NQOPSQFFQJCQKH-KRWDZBQOSA-N
Formula
C21H25F3N4O3
Mass
438.451
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
Phenoxy compounds Dialkylarylamines Methoxybenzenes Pyrimidones Alkyl aryl ethers Aminopyrimidines and derivatives Morpholines Imidolactams Vinylogous amides Heteroaromatic compounds Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Alkyl fluorides Organofluorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - Anisole - Dialkylarylamine - Methoxybenzene - Alkyl aryl ether - Aminopyrimidine - Pyrimidone - Monocyclic benzene moiety - Morpholine - Oxazinane - Pyrimidine - Imidolactam - Heteroaromatic compound - Vinylogous amide - Tertiary amine - Lactam - Azacycle - Oxacycle - Organoheterocyclic compound - Dialkyl ether - Ether - Organic oxygen compound - Alkyl fluoride - Organohalogen compound - Organofluoride - Organonitrogen compound - Organic nitrogen compound - Organic oxide - Organooxygen compound - Alkyl halide - Amine - Hydrocarbon derivative - 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