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

Systemtic Name: 5-[[(2R)-2-methyl-4-(4-methylphenyl)piperazin-1-ium-1-yl]methyl]-3-pyridin-2-yl-1,2,4-oxadiazole Openeye Name: 5-[[(2R)-2-methyl-4-(p-tolyl)piperazin-1-ium-1-yl]methyl]-3-(2-pyridyl)-1,2,4-oxadiazole CAS Name: 5-[[(2R)-2-methyl-4-(4-methylphenyl)-1-piperazin-1-iumyl]methyl]-3-(2-pyridinyl)-1,2,4-oxadiazole IUPAC Name: 5-[[(2R)-2-methyl-4-(4-methylphenyl)piperazin-1-ium-1-yl]methyl]-3-pyridin-2-yl-1,2,4-oxadiazole Traditional Name: 5-[[(2R)-2-methyl-4-(p-tolyl)piperazin-1-ium-1-yl]methyl]-3-(2-pyridyl)-1,2,4-oxadiazole Formula: C20H24N5O+ MolecularWeight: 350.43746

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CC=N3)C4=CC=C(C=C4)C

Isomeric SMILES

C[C@@H]1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CC=N3)C4=CC=C(C=C4)C

InChI

InChI=1S/C20H23N5O/c1-15-6-8-17(9-7-15)25-12-11-24(16(2)13-25)14-19-22-20(23-26-19)18-5-3-4-10-21-18/h3-10,16H,11-14H2,1-2H3/p+1/t16-/m1/s1