Compound Identification
SMILES
FC(F)(F)C1=NC2=C(N1)C=CC1=C2OC(CNCCCCC2=CC=CC=C2)CO1
InChIKey
InChIKey=XNARKFPKLORHQH-UHFFFAOYSA-N
Formula
C21H22F3N3O2
Mass
405.421
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Benzo-1,4-dioxanes Benzimidazoles Aralkylamines Alkyl aryl ethers Para dioxins Imidazoles Heteroaromatic compounds Oxacyclic compounds Dialkylamines Azacyclic compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Benzo-1,4-dioxane - Benzodioxane - Benzimidazole - Alkyl aryl ether - Aralkylamine - Para-dioxin - Azole - Heteroaromatic compound - Imidazole - Oxacycle - Azacycle - Secondary aliphatic amine - Ether - Organoheterocyclic compound - Secondary amine - Amine - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available