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

Systemtic Name: 2-(2-bromophenyl)-5-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole Openeye Name: 2-(2-bromophenyl)-5-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole CAS Name: 2-(2-bromophenyl)-5-[[4-(2-methylphenyl)-1-piperazin-1-iumyl]methyl]-1,3,4-oxadiazole IUPAC Name: 2-(2-bromophenyl)-5-[[4-(2-methylphenyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole Traditional Name: 2-(2-bromophenyl)-5-[[4-(o-tolyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole Formula: C20H22BrN4O+ MolecularWeight: 414.31888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=NN=C(O3)C4=CC=CC=C4Br

Isomeric SMILES

CC1=CC=CC=C1N2CC[NH+](CC2)CC3=NN=C(O3)C4=CC=CC=C4Br

InChI

InChI=1S/C20H21BrN4O/c1-15-6-2-5-9-18(15)25-12-10-24(11-13-25)14-19-22-23-20(26-19)16-7-3-4-8-17(16)21/h2-9H,10-14H2,1H3/p+1