7-[4-(4-fluorophenyl)piperazin-1-yl]-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole

Systemtic Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole Openeye Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole CAS Name: 7-[4-(4-fluorophenyl)-1-piperazinyl]-4-nitro-5-(1-pyrrolidinyl)-2,1,3-benzoxadiazole IUPAC Name: 7-[4-(4-fluorophenyl)piperazin-1-yl]-4-nitro-5-pyrrolidin-1-yl-2,1,3-benzoxadiazole Traditional Name: 7-[4-(4-fluorophenyl)piperazino]-4-nitro-5-pyrrolidino-benzofurazan Formula: C20H21FN6O3 MolecularWeight: 412.417543

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C3=NON=C3C(=C2)N4CCN(CC4)C5=CC=C(C=C5)F)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C3=NON=C3C(=C2)N4CCN(CC4)C5=CC=C(C=C5)F)[N+](=O)[O-]

InChI

InChI=1S/C20H21FN6O3/c21-14-3-5-15(6-4-14)24-9-11-26(12-10-24)16-13-17(25-7-1-2-8-25)20(27(28)29)19-18(16)22-30-23-19/h3-6,13H,1-2,7-12H2