N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[2-(phenylsulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[2-(benzenesulfonyl)-3,4-dihydro-1H-isoquinolin-7-yl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-(2-besyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-(trifluoromethyl)benzenesulfonamide Formula: C22H19F3N2O4S2 MolecularWeight: 496.52247

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H19F3N2O4S2/c23-22(24,25)18-5-4-8-21(14-18)32(28,29)26-19-10-9-16-11-12-27(15-17(16)13-19)33(30,31)20-6-2-1-3-7-20/h1-10,13-14,26H,11-12,15H2