2-[4-(2-ethoxypyridin-3-yl)carbonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)ethanamide

Systemtic Name: 2-[4-(2-ethoxypyridin-3-yl)carbonylpiperazin-1-ium-1-yl]-N-(3-fluorophenyl)ethanamide Openeye Name: 2-[4-(2-ethoxypyridine-3-carbonyl)piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide CAS Name: 2-[4-[(2-ethoxy-3-pyridinyl)-oxomethyl]-1-piperazin-1-iumyl]-N-(3-fluorophenyl)acetamide IUPAC Name: 2-[4-(2-ethoxypyridine-3-carbonyl)piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide Traditional Name: 2-[4-(2-ethoxynicotinoyl)piperazin-1-ium-1-yl]-N-(3-fluorophenyl)acetamide Formula: C20H24FN4O3+ MolecularWeight: 387.427963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)F

InChI

InChI=1S/C20H23FN4O3/c1-2-28-19-17(7-4-8-22-19)20(27)25-11-9-24(10-12-25)14-18(26)23-16-6-3-5-15(21)13-16/h3-8,13H,2,9-12,14H2,1H3,(H,23,26)/p+1