2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(4-nitro-2,1,3-benzoxadiazol-7-yl)piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(7-nitrobenzofurazan-4-yl)piperazino]-1-pyrrolidino-ethanone Formula: C16H20N6O4 MolecularWeight: 360.3678

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCN(CC2)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCN(CC2)C3=CC=C(C4=NON=C34)[N+](=O)[O-]

InChI

InChI=1S/C16H20N6O4/c23-14(21-5-1-2-6-21)11-19-7-9-20(10-8-19)12-3-4-13(22(24)25)16-15(12)17-26-18-16/h3-4H,1-2,5-11H2