3-(3,4-dimethoxyphenyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]-1,2,4-oxadiazole

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]-1,2,4-oxadiazole Openeye Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]-1,2,4-oxadiazole CAS Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-nitrophenyl)-1-piperazinyl]-1,2,4-oxadiazole IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-nitrophenyl)piperazin-1-yl]-1,2,4-oxadiazole Traditional Name: 3-(3,4-dimethoxyphenyl)-5-[4-(4-nitrophenyl)piperazino]-1,2,4-oxadiazole Formula: C20H21N5O5 MolecularWeight: 411.41124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NOC(=N2)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NOC(=N2)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C20H21N5O5/c1-28-17-8-3-14(13-18(17)29-2)19-21-20(30-22-19)24-11-9-23(10-12-24)15-4-6-16(7-5-15)25(26)27/h3-8,13H,9-12H2,1-2H3