2-chloranyl-N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyl)benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyl)benzenesulfonamide Openeye Name: 2-chloro-N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyl)benzenesulfonamide CAS Name: 2-chloro-N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyl)benzenesulfonamide IUPAC Name: 2-chloro-N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyl)benzenesulfonamide Traditional Name: 2-chloro-N-[4-(3,4-dihydroisoquinolin-1-yl)phenyl]-4-(trifluoromethyl)benzenesulfonamide Formula: C22H16ClF3N2O2S MolecularWeight: 464.88785

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Descriptors Computed from Structure

Canonical SMILES:

C1CN=C(C2=CC=CC=C21)C3=CC=C(C=C3)NS(=O)(=O)C4=C(C=C(C=C4)C(F)(F)F)Cl

Isomeric SMILES

C1CN=C(C2=CC=CC=C21)C3=CC=C(C=C3)NS(=O)(=O)C4=C(C=C(C=C4)C(F)(F)F)Cl

InChI

InChI=1S/C22H16ClF3N2O2S/c23-19-13-16(22(24,25)26)7-10-20(19)31(29,30)28-17-8-5-15(6-9-17)21-18-4-2-1-3-14(18)11-12-27-21/h1-10,13,28H,11-12H2