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

Systemtic Name: 3-pyrazin-2-yl-5-[(4-pyridin-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-pyrazin-2-yl-5-[[4-(4-pyridyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(2-pyrazinyl)-5-[(4-pyridin-4-yl-1-piperidin-1-iumyl)methyl]-1,2,4-oxadiazole IUPAC Name: 3-pyrazin-2-yl-5-[(4-pyridin-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-pyrazin-2-yl-5-[[4-(4-pyridyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C17H19N6O+ MolecularWeight: 323.37236

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CC=NC=C2)CC3=NC(=NO3)C4=NC=CN=C4

Isomeric SMILES

C1C[NH+](CCC1C2=CC=NC=C2)CC3=NC(=NO3)C4=NC=CN=C4

InChI

InChI=1S/C17H18N6O/c1-5-18-6-2-13(1)14-3-9-23(10-4-14)12-16-21-17(22-24-16)15-11-19-7-8-20-15/h1-2,5-8,11,14H,3-4,9-10,12H2/p+1