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

Systemtic Name: 3-[1-(4-methylphenyl)cyclopentyl]-5-[(4-pyridin-3-yloxypiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Openeye Name: 3-[1-(p-tolyl)cyclopentyl]-5-[[4-(3-pyridyloxy)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-[1-(4-methylphenyl)cyclopentyl]-5-[[4-(3-pyridinyloxy)-1-piperidin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-[1-(4-methylphenyl)cyclopentyl]-5-[(4-pyridin-3-yloxypiperidin-1-ium-1-yl)methyl]-1,2,4-oxadiazole Traditional Name: 3-[1-(p-tolyl)cyclopentyl]-5-[[4-(3-pyridyloxy)piperidin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C25H31N4O2+ MolecularWeight: 419.53924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CCCC2)C3=NOC(=N3)C[NH+]4CCC(CC4)OC5=CN=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2(CCCC2)C3=NOC(=N3)C[NH+]4CCC(CC4)OC5=CN=CC=C5

InChI

InChI=1S/C25H30N4O2/c1-19-6-8-20(9-7-19)25(12-2-3-13-25)24-27-23(31-28-24)18-29-15-10-21(11-16-29)30-22-5-4-14-26-17-22/h4-9,14,17,21H,2-3,10-13,15-16,18H2,1H3/p+1