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

Systemtic Name: 5-[(1-methylpiperidin-1-ium-4-yl)methyl]-3-pyridin-4-yl-1,2,4-oxadiazole Openeye Name: 5-[(1-methylpiperidin-1-ium-4-yl)methyl]-3-(4-pyridyl)-1,2,4-oxadiazole CAS Name: 5-[(1-methyl-4-piperidin-1-iumyl)methyl]-3-pyridin-4-yl-1,2,4-oxadiazole IUPAC Name: 5-[(1-methylpiperidin-1-ium-4-yl)methyl]-3-pyridin-4-yl-1,2,4-oxadiazole Traditional Name: 5-[(1-methylpiperidin-1-ium-4-yl)methyl]-3-(4-pyridyl)-1,2,4-oxadiazole Formula: C14H19N4O+ MolecularWeight: 259.32686

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CC2=NC(=NO2)C3=CC=NC=C3

Isomeric SMILES

C[NH+]1CCC(CC1)CC2=NC(=NO2)C3=CC=NC=C3

InChI

InChI=1S/C14H18N4O/c1-18-8-4-11(5-9-18)10-13-16-14(17-19-13)12-2-6-15-7-3-12/h2-3,6-7,11H,4-5,8-10H2,1H3/p+1