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

Systemtic Name: 3-(4-methoxyphenyl)-5-[(4-pyridin-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-(4-methoxyphenyl)-5-[[4-(4-pyridyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(4-methoxyphenyl)-5-[(4-pyridin-4-yl-1-piperidin-1-iumyl)methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-methoxyphenyl)-5-[(4-pyridin-4-ylpiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-(4-methoxyphenyl)-5-[[4-(4-pyridyl)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C20H23N4O2+ MolecularWeight: 351.42222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O2/c1-25-18-4-2-17(3-5-18)20-22-19(26-23-20)14-24-12-8-16(9-13-24)15-6-10-21-11-7-15/h2-7,10-11,16H,8-9,12-14H2,1H3/p+1