1-[2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxy-ethanone

Systemtic Name: 1-[2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxy-ethanone Openeye Name: 1-[2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxy-ethanone CAS Name: 1-[2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]-1-piperazinyl]-2-phenoxyethanone IUPAC Name: 1-[2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]piperazin-1-yl]-2-phenoxyethanone Traditional Name: 1-[2-[3-(4-nitrophenyl)-1,2,4-oxadiazol-5-yl]piperazino]-2-phenoxy-ethanone Formula: C20H19N5O5 MolecularWeight: 409.39536

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)C2=NC(=NO2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)COC4=CC=CC=C4

Isomeric SMILES

C1CN(C(CN1)C2=NC(=NO2)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C20H19N5O5/c26-18(13-29-16-4-2-1-3-5-16)24-11-10-21-12-17(24)20-22-19(23-30-20)14-6-8-15(9-7-14)25(27)28/h1-9,17,21H,10-13H2