N-[3-(7-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[3-(7-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-(7-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-3-(trifluoromethyl)benzenesulfonamide Formula: C22H16F4N2O2S MolecularWeight: 448.433253

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H16F4N2O2S/c23-17-8-7-14-9-10-27-21(20(14)13-17)15-3-1-5-18(11-15)28-31(29,30)19-6-2-4-16(12-19)22(24,25)26/h1-8,11-13,28H,9-10H2