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

Systemtic Name: 3-pyrazin-2-yl-5-[[(2S)-2-(2-pyridin-2-ylethyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-pyrazin-2-yl-5-[[(2S)-2-[2-(2-pyridyl)ethyl]piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(2-pyrazinyl)-5-[[(2S)-2-[2-(2-pyridinyl)ethyl]-1-piperidin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-pyrazin-2-yl-5-[[(2S)-2-(2-pyridin-2-ylethyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-pyrazin-2-yl-5-[[(2S)-2-[2-(2-pyridyl)ethyl]piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C19H23N6O+ MolecularWeight: 351.42552

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)CCC2=CC=CC=N2)CC3=NC(=NO3)C4=NC=CN=C4

Isomeric SMILES

C1CC[NH+]([C@@H](C1)CCC2=CC=CC=N2)CC3=NC(=NO3)C4=NC=CN=C4

InChI

InChI=1S/C19H22N6O/c1-3-9-21-15(5-1)7-8-16-6-2-4-12-25(16)14-18-23-19(24-26-18)17-13-20-10-11-22-17/h1,3,5,9-11,13,16H,2,4,6-8,12,14H2/p+1/t16-/m0/s1