N-[4-(5-fluoranyl-3,4-dihydroisoquinolin-1-yl)-2-methoxy-phenyl]-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[4-(5-fluoranyl-3,4-dihydroisoquinolin-1-yl)-2-methoxy-phenyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[4-(5-fluoro-3,4-dihydroisoquinolin-1-yl)-2-methoxy-phenyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[4-(5-fluoro-3,4-dihydroisoquinolin-1-yl)-2-methoxyphenyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[4-(5-fluoro-3,4-dihydroisoquinolin-1-yl)-2-methoxyphenyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[4-(5-fluoro-3,4-dihydroisoquinolin-1-yl)-2-methoxy-phenyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C23H18F4N2O4S MolecularWeight: 494.458633

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NCCC3=C2C=CC=C3F)NS(=O)(=O)C4=CC=C(C=C4)OC(F)(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NCCC3=C2C=CC=C3F)NS(=O)(=O)C4=CC=C(C=C4)OC(F)(F)F

InChI

InChI=1S/C23H18F4N2O4S/c1-32-21-13-14(22-18-3-2-4-19(24)17(18)11-12-28-22)5-10-20(21)29-34(30,31)16-8-6-15(7-9-16)33-23(25,26)27/h2-10,13,29H,11-12H2,1H3