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

Systemtic Name: 5-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole Openeye Name: 5-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-3-(p-tolyl)-1,2,4-oxadiazole CAS Name: 5-[[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-3-(4-methylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]-3-(p-tolyl)-1,2,4-oxadiazole Formula: C21H25N4O2+ MolecularWeight: 365.4488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=N2)C[NH+]3CCN(CC3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C21H24N4O2/c1-16-3-5-17(6-4-16)21-22-20(27-23-21)15-24-11-13-25(14-12-24)18-7-9-19(26-2)10-8-18/h3-10H,11-15H2,1-2H3/p+1