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

Systemtic Name: 3-(furan-2-yl)-5-[[4-(2-nitrophenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(2-furyl)-5-[[4-(2-nitrophenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(2-furanyl)-5-[[4-(2-nitrophenyl)-1-piperazin-1-iumyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(furan-2-yl)-5-[[4-(2-nitrophenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-(2-furyl)-5-[[4-(2-nitrophenyl)piperazin-1-ium-1-yl]methyl]-1,2,4-oxadiazole Formula: C17H18N5O4+ MolecularWeight: 356.35592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CO3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CO3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O4/c23-22(24)14-5-2-1-4-13(14)21-9-7-20(8-10-21)12-16-18-17(19-26-16)15-6-3-11-25-15/h1-6,11H,7-10,12H2/p+1