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

Systemtic Name: 3-(phenoxymethyl)-5-[(4-pyridin-3-yloxypiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-(phenoxymethyl)-5-[[4-(3-pyridyloxy)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(phenoxymethyl)-5-[[4-(3-pyridinyloxy)-1-piperidin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(phenoxymethyl)-5-[(4-pyridin-3-yloxypiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-(phenoxymethyl)-5-[[4-(3-pyridyloxy)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C20H23N4O3+ MolecularWeight: 367.42162

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1OC2=CN=CC=C2)CC3=NC(=NO3)COC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1OC2=CN=CC=C2)CC3=NC(=NO3)COC4=CC=CC=C4

InChI

InChI=1S/C20H22N4O3/c1-2-5-16(6-3-1)25-15-19-22-20(27-23-19)14-24-11-8-17(9-12-24)26-18-7-4-10-21-13-18/h1-7,10,13,17H,8-9,11-12,14-15H2/p+1