5-bromanyl-1-ethanoyl-N-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-2,3-dihydroindole-7-sulfonamide

Systemtic Name: 5-bromanyl-1-ethanoyl-N-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-2,3-dihydroindole-7-sulfonamide Openeye Name: 1-acetyl-5-bromo-N-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]indoline-7-sulfonamide CAS Name: 1-acetyl-5-bromo-N-[2-[4-(2-fluorophenyl)-1-piperazin-1-iumyl]ethyl]-2,3-dihydroindole-7-sulfonamide IUPAC Name: 1-acetyl-5-bromo-N-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]-2,3-dihydroindole-7-sulfonamide Traditional Name: 1-acetyl-5-bromo-N-[2-[4-(2-fluorophenyl)piperazin-1-ium-1-yl]ethyl]indoline-7-sulfonamide Formula: C22H27BrFN4O3S+ MolecularWeight: 526.442183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4F)Br

Isomeric SMILES

CC(=O)N1CCC2=CC(=CC(=C21)S(=O)(=O)NCC[NH+]3CCN(CC3)C4=CC=CC=C4F)Br

InChI

InChI=1S/C22H26BrFN4O3S/c1-16(29)28-8-6-17-14-18(23)15-21(22(17)28)32(30,31)25-7-9-26-10-12-27(13-11-26)20-5-3-2-4-19(20)24/h2-5,14-15,25H,6-13H2,1H3/p+1