3-[(4-methoxyphenyl)methyl]-5-[6-(4-methoxypiperidin-1-yl)pyridin-1-ium-3-yl]-1,2,4-oxadiazole

Systemtic Name: 3-[(4-methoxyphenyl)methyl]-5-[6-(4-methoxypiperidin-1-yl)pyridin-1-ium-3-yl]-1,2,4-oxadiazole Openeye Name: 3-[(4-methoxyphenyl)methyl]-5-[6-(4-methoxy-1-piperidyl)pyridin-1-ium-3-yl]-1,2,4-oxadiazole CAS Name: 3-[(4-methoxyphenyl)methyl]-5-[6-(4-methoxy-1-piperidinyl)-3-pyridin-1-iumyl]-1,2,4-oxadiazole IUPAC Name: 3-[(4-methoxyphenyl)methyl]-5-[6-(4-methoxypiperidin-1-yl)pyridin-1-ium-3-yl]-1,2,4-oxadiazole Traditional Name: 5-[6-(4-methoxypiperidino)pyridin-1-ium-3-yl]-3-p-anisyl-1,2,4-oxadiazole Formula: C21H25N4O3+ MolecularWeight: 381.4482

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)C2=[NH+]C=C(C=C2)C3=NC(=NO3)CC4=CC=C(C=C4)OC

Isomeric SMILES

COC1CCN(CC1)C2=[NH+]C=C(C=C2)C3=NC(=NO3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C21H24N4O3/c1-26-17-6-3-15(4-7-17)13-19-23-21(28-24-19)16-5-8-20(22-14-16)25-11-9-18(27-2)10-12-25/h3-8,14,18H,9-13H2,1-2H3/p+1