N-(4-fluorophenyl)-2-[4-[(2-oxidanylidene-1H-pyridin-3-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[4-[(2-oxidanylidene-1H-pyridin-3-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[4-(2-oxo-1H-pyridine-3-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(4-fluorophenyl)-2-[4-[oxo-(2-oxo-1H-pyridin-3-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[4-(2-oxo-1H-pyridine-3-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[4-(2-keto-1H-pyridine-3-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C18H20FN4O3+ MolecularWeight: 359.374803

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)C3=CC=CNC3=O

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=C(C=C2)F)C(=O)C3=CC=CNC3=O

InChI

InChI=1S/C18H19FN4O3/c19-13-3-5-14(6-4-13)21-16(24)12-22-8-10-23(11-9-22)18(26)15-2-1-7-20-17(15)25/h1-7H,8-12H2,(H,20,25)(H,21,24)/p+1