N'-(4-fluorophenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]ethanediamide

Systemtic Name: N'-(4-fluorophenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]ethanediamide Openeye Name: N'-(4-fluorophenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]oxamide CAS Name: N'-(4-fluorophenyl)-N-[[4-(1-piperidin-1-iumylmethyl)phenyl]methyl]oxamide IUPAC Name: N'-(4-fluorophenyl)-N-[[4-(piperidin-1-ium-1-ylmethyl)phenyl]methyl]oxamide Traditional Name: N'-(4-fluorophenyl)-N-[4-(piperidin-1-ium-1-ylmethyl)benzyl]oxamide Formula: C21H25FN3O2+ MolecularWeight: 370.440503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1CC[NH+](CC1)CC2=CC=C(C=C2)CNC(=O)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C21H24FN3O2/c22-18-8-10-19(11-9-18)24-21(27)20(26)23-14-16-4-6-17(7-5-16)15-25-12-2-1-3-13-25/h4-11H,1-3,12-15H2,(H,23,26)(H,24,27)/p+1