(E)-N-[3-(6-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]-2-phenyl-ethenesulfonamide

Systemtic Name: (E)-N-[3-(6-fluoranyl-3,4-dihydroisoquinolin-1-yl)phenyl]-2-phenyl-ethenesulfonamide Openeye Name: (E)-N-[3-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2-phenyl-ethenesulfonamide CAS Name: (E)-N-[3-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2-phenylethenesulfonamide IUPAC Name: (E)-N-[3-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2-phenylethenesulfonamide Traditional Name: (E)-N-[3-(6-fluoro-3,4-dihydroisoquinolin-1-yl)phenyl]-2-phenyl-ethenesulfonamide Formula: C23H19FN2O2S MolecularWeight: 406.472563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=C1C=C(C=C2)F)C3=CC(=CC=C3)NS(=O)(=O)C=CC4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H19FN2O2S/c24-20-9-10-22-18(15-20)11-13-25-23(22)19-7-4-8-21(16-19)26-29(27,28)14-12-17-5-2-1-3-6-17/h1-10,12,14-16,26H,11,13H2/b14-12+