4-bromanyl-2-fluoranyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-bromanyl-2-fluoranyl-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-bromo-2-fluoro-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-bromo-2-fluoro-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-bromo-2-fluoro-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-bromo-2-fluoro-N-[4-(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=C(C=C2)CNC(=O)C3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C20H22BrFN2O/c21-17-8-9-18(19(22)12-17)20(25)23-13-15-4-6-16(7-5-15)14-24-10-2-1-3-11-24/h4-9,12H,1-3,10-11,13-14H2,(H,23,25)/p+1