Compound Identification
SMILES
CC(C)CC1=NOC(=C1)C1(CC1)NC[C@@H](O)[C@H](CC1=CC(F)=CC(F)=C1)NC(C)=O
InChIKey
InChIKey=HLCWFSFOWQTZPY-VQTJNVASSA-N
Formula
C22H29F2N3O3
Mass
421.489
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
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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
Amphetamines and derivatives 5-cyclopropylisoxazoles Fluorobenzenes Aralkylamines Aryl fluorides Acetamides Heteroaromatic compounds Secondary carboxylic acid amides Secondary alcohols 1,2-aminoalcohols Amino acids and derivatives Oxacyclic compounds Dialkylamines Azacyclic compounds Hydrocarbon derivatives Organofluorides Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - 5-cyclopropylisoxazole - Cyclopropylisoxazole - Fluorobenzene - Halobenzene - Aralkylamine - Aryl fluoride - Aryl halide - Isoxazole - Azole - Heteroaromatic compound - Acetamide - Secondary alcohol - Amino acid or derivatives - 1,2-aminoalcohol - Carboxamide group - Secondary carboxylic acid amide - Secondary amine - Oxacycle - Carboxylic acid derivative - Organoheterocyclic compound - Azacycle - Secondary aliphatic amine - Organic nitrogen compound - Organohalogen compound - Organofluoride - Carbonyl group - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Alcohol - Aromatic heteromonocyclic 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