Compound Identification
SMILES
CS(=O)(=O)OC1NC(CC2=CC=CC=C2)C2CCC3=C(C=CC(=C3)C(F)(F)F)C12
InChIKey
InChIKey=FBWNARQXWATYLZ-UHFFFAOYSA-N
Formula
C21H22F3NO3S
Mass
425.47
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Tetralins
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Tetralins
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Tetralins
Alternative Parents
Isoindolines Isoindoles Sulfonic acid esters Organosulfonic acid esters Benzene and substituted derivatives Sulfonyls Pyrrolidines Methanesulfonates Azacyclic compounds Organooxygen compounds Organonitrogen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Tetralin - Isoindoline - Isoindole - Isoindole or derivatives - Monocyclic benzene moiety - Organosulfonic acid ester - Sulfonic acid ester - Sulfonyl - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Pyrrolidine - Methanesulfonate - Azacycle - Organoheterocyclic compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Organosulfur compound - Alkyl halide - Alkyl fluoride - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as tetralins. These are polycyclic aromatic compounds containing a tetralin moiety, which consists of a benzene fused to a cyclohexane.
External Descriptors
Not available