N-(1-ethylquinolin-1-ium-4-yl)iminobenzenesulfonamide tetrafluoroborate

Systemtic Name: N-(1-ethylquinolin-1-ium-4-yl)iminobenzenesulfonamide tetrafluoroborate Openeye Name: N-(1-ethylquinolin-1-ium-4-yl)iminobenzenesulfonamide tetrafluoroborate CAS Name: N-[(1-ethyl-4-quinolin-1-iumyl)imino]benzenesulfonamide tetrafluoroborate IUPAC Name: N-(1-ethylquinolin-1-ium-4-yl)iminobenzenesulfonamide tetrafluoroborate Traditional Name: N-(1-ethylquinolin-1-ium-4-yl)iminobenzenesulfonamide tetrafluoroborate Formula: C17H16BF4N3O2S MolecularWeight: 413.197453

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[B-](F)(F)(F)F.CC[N+]1=CC=C(C2=CC=CC=C21)N=NS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

[B-](F)(F)(F)F.CC[N+]1=CC=C(C2=CC=CC=C21)N=NS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C17H16N3O2S.BF4/c1-2-20-13-12-16(15-10-6-7-11-17(15)20)18-19-23(21,22)14-8-4-3-5-9-14;2-1(3,4)5/h3-13H,2H2,1H3;/q+1;-1