2-[4-(6-methoxypyridin-3-yl)carbonylpiperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-[4-(6-methoxypyridin-3-yl)carbonylpiperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[4-(6-methoxypyridine-3-carbonyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[4-[(6-methoxy-3-pyridinyl)-oxomethyl]-1-piperazin-1-iumyl]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-[4-(6-methoxypyridine-3-carbonyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[4-(6-methoxynicotinoyl)piperazin-1-ium-1-yl]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C20H22F3N4O3+ MolecularWeight: 423.40889

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

COC1=NC=C(C=C1)C(=O)N2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H21F3N4O3/c1-30-18-7-6-14(12-24-18)19(29)27-10-8-26(9-11-27)13-17(28)25-16-5-3-2-4-15(16)20(21,22)23/h2-7,12H,8-11,13H2,1H3,(H,25,28)/p+1