5-bromanyl-2-fluoranyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 5-bromanyl-2-fluoranyl-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 5-bromo-2-fluoro-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 5-bromo-2-fluoro-N-[[2-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 5-bromo-2-fluoro-N-[[2-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 5-bromo-2-fluoro-N-[2-(piperidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C20H23BrFN2O+ MolecularWeight: 406.311823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=C(C=CC(=C3)Br)F

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=CC=C2CNC(=O)C3=C(C=CC(=C3)Br)F

InChI

InChI=1S/C20H22BrFN2O/c21-17-8-9-19(22)18(12-17)20(25)23-13-15-6-2-3-7-16(15)14-24-10-4-1-5-11-24/h2-3,6-9,12H,1,4-5,10-11,13-14H2,(H,23,25)/p+1