N-[4-(6-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[4-(6-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[4-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C22H16F4N2O3S MolecularWeight: 464.432653

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C1C=C(C=C2)F)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

C1CN=C(C2=C1C=C(C=C2)F)C3=CC=C(C=C3)NS(=O)(=O)C4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C22H16F4N2O3S/c23-16-3-10-20-15(13-16)11-12-27-21(20)14-1-4-17(5-2-14)28-32(29,30)19-8-6-18(7-9-19)31-22(24,25)26/h1-10,13,28H,11-12H2