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

Systemtic Name: 3-(4-methoxyphenyl)-5-[[4-(5-nitropyridin-2-yl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-(4-methoxyphenyl)-5-[[4-(5-nitro-2-pyridyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-(4-methoxyphenyl)-5-[[4-(5-nitro-2-pyridinyl)-1-piperazinyl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(4-methoxyphenyl)-5-[[4-(5-nitropyridin-2-yl)piperazin-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-(4-methoxyphenyl)-5-[[4-(5-nitro-2-pyridyl)piperazino]methyl]-1,2,4-oxadiazole Formula: C19H20N6O4 MolecularWeight: 396.3999

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=NC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=NOC(=N2)CN3CCN(CC3)C4=NC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H20N6O4/c1-28-16-5-2-14(3-6-16)19-21-18(29-22-19)13-23-8-10-24(11-9-23)17-7-4-15(12-20-17)25(26)27/h2-7,12H,8-11,13H2,1H3