3-pyridin-2-yl-5-[[(2S)-2-pyridin-2-ylpiperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 3-pyridin-2-yl-5-[[(2S)-2-pyridin-2-ylpiperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(2-pyridyl)-5-[[(2S)-2-(2-pyridyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(2-pyridinyl)-5-[[(2S)-2-(2-pyridinyl)-1-piperidin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-pyridin-2-yl-5-[[(2S)-2-pyridin-2-ylpiperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-(2-pyridyl)-5-[[(2S)-2-(2-pyridyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C18H20N5O+ MolecularWeight: 322.3843

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C2=CC=CC=N2)CC3=NC(=NO3)C4=CC=CC=N4

Isomeric SMILES

C1CC[NH+]([C@@H](C1)C2=CC=CC=N2)CC3=NC(=NO3)C4=CC=CC=N4

InChI

InChI=1S/C18H19N5O/c1-4-10-19-14(7-1)16-9-3-6-12-23(16)13-17-21-18(22-24-17)15-8-2-5-11-20-15/h1-2,4-5,7-8,10-11,16H,3,6,9,12-13H2/p+1/t16-/m0/s1