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

Systemtic Name: 5-[(4-pyridin-3-yloxypiperidin-1-ium-1-yl)methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole Openeye Name: 5-[[4-(3-pyridyloxy)piperidin-1-ium-1-yl]methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole CAS Name: 5-[[4-(3-pyridinyloxy)-1-piperidin-1-iumyl]methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(4-pyridin-3-yloxypiperidin-1-ium-1-yl)methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[4-(3-pyridyloxy)piperidin-1-ium-1-yl]methyl]-3-(2,3,4-trimethoxyphenyl)-1,2,4-oxadiazole Formula: C22H27N4O5+ MolecularWeight: 427.47358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)OC4=CN=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C2=NOC(=N2)C[NH+]3CCC(CC3)OC4=CN=CC=C4)OC)OC

InChI

InChI=1S/C22H26N4O5/c1-27-18-7-6-17(20(28-2)21(18)29-3)22-24-19(31-25-22)14-26-11-8-15(9-12-26)30-16-5-4-10-23-13-16/h4-7,10,13,15H,8-9,11-12,14H2,1-3H3/p+1