N-[4-(7-phenoxy-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyloxy)benzenesulfonamide

Systemtic Name: N-[4-(7-phenoxy-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyloxy)benzenesulfonamide Openeye Name: N-[4-(7-phenoxy-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide CAS Name: N-[4-(7-phenoxy-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide IUPAC Name: N-[4-(7-phenoxy-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide Traditional Name: N-[4-(7-phenoxy-3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethoxy)benzenesulfonamide Formula: C28H21F3N2O4S MolecularWeight: 538.53755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C1C=CC(=C2)OC3=CC=CC=C3)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=C(C=C5)OC(F)(F)F

Isomeric SMILES

C1CN=C(C2=C1C=CC(=C2)OC3=CC=CC=C3)C4=CC=C(C=C4)NS(=O)(=O)C5=CC=C(C=C5)OC(F)(F)F

InChI

InChI=1S/C28H21F3N2O4S/c29-28(30,31)37-23-12-14-25(15-13-23)38(34,35)33-21-9-6-20(7-10-21)27-26-18-24(11-8-19(26)16-17-32-27)36-22-4-2-1-3-5-22/h1-15,18,33H,16-17H2