Compound Identification
SMILES
CC(C)CN(C[C@@H](O)[C@H](CC1=CC=CC=C1)NC(=O)O[C@H]1CO[C@H]2OCC[C@@H]12)S(=O)(=O)C1=CC2=C(ON=C2CNC(=O)C(F)(F)C(F)(F)F)C=C1
InChIKey
InChIKey=OAZUFWOTCVJYNM-IWFMCKTASA-N
Formula
C32H37F5N4O9S
Mass
748.72
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 Perfluoroalkyl carboxylic acid and derivatives Benzisoxazoles Furofurans Organosulfonamides Aminosulfonyl compounds Carbamate esters Oxolanes Heteroaromatic compounds Isoxazoles Secondary alcohols Secondary carboxylic acid amides Azacyclic compounds Acetals Oxacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organofluorides Organonitrogen compounds Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylbutylamine - Amphetamine or derivatives - Perfluoroalkyl carboxylic acid or derivatives - Benzisoxazole - Furofuran - Organosulfonic acid amide - Azole - Isoxazole - Heteroaromatic compound - Oxolane - Organic sulfonic acid or derivatives - Aminosulfonyl compound - Carbamic acid ester - Sulfonyl - Organosulfonic acid or derivatives - Carboxamide group - Secondary alcohol - Secondary carboxylic acid amide - Azacycle - Oxacycle - Organoheterocyclic compound - Acetal - Carboxylic acid derivative - Organosulfur compound - Organofluoride - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alcohol - Alkyl fluoride - 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