N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C20H23F3N2O3S MolecularWeight: 428.46843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCCNS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCCNS(=O)(=O)C3=CC=C(C=C3)OC(F)(F)F

InChI

InChI=1S/C20H23F3N2O3S/c21-20(22,23)28-18-7-9-19(10-8-18)29(26,27)24-12-3-4-13-25-14-11-16-5-1-2-6-17(16)15-25/h1-2,5-10,24H,3-4,11-15H2