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

Systemtic Name: 3-(4-chlorophenyl)-5-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(4-chlorophenyl)-5-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(4-chlorophenyl)-5-[[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-chlorophenyl)-5-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-(4-chlorophenyl)-5-[[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C20H22ClN4O2+ MolecularWeight: 385.86728

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CC3=NC(=NO3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN4O2/c1-26-18-5-3-2-4-17(18)25-12-10-24(11-13-25)14-19-22-20(23-27-19)15-6-8-16(21)9-7-15/h2-9H,10-14H2,1H3/p+1