2-[(3-fluoranylphenoxy)methyl]-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-[(3-fluoranylphenoxy)methyl]-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-[(3-fluorophenoxy)methyl]-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]oxazole-4-carboxamide CAS Name: 2-[(3-fluorophenoxy)methyl]-N-[[(2S)-1-methyl-2-piperidin-1-iumyl]methyl]-4-oxazolecarboxamide IUPAC Name: 2-[(3-fluorophenoxy)methyl]-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[(3-fluorophenoxy)methyl]-N-[[(2S)-1-methylpiperidin-1-ium-2-yl]methyl]oxazole-4-carboxamide Formula: C18H23FN3O3+ MolecularWeight: 348.391923

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCCC1CNC(=O)C2=COC(=N2)COC3=CC(=CC=C3)F

Isomeric SMILES

C[NH+]1CCCC[C@H]1CNC(=O)C2=COC(=N2)COC3=CC(=CC=C3)F

InChI

InChI=1S/C18H22FN3O3/c1-22-8-3-2-6-14(22)10-20-18(23)16-11-25-17(21-16)12-24-15-7-4-5-13(19)9-15/h4-5,7,9,11,14H,2-3,6,8,10,12H2,1H3,(H,20,23)/p+1/t14-/m0/s1