1-[4-(4-fluoranyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanone

Systemtic Name: 1-[4-(4-fluoranyl-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanone Openeye Name: 1-[4-(4-fluoro-3-nitro-phenyl)sulfonylpiperazin-1-yl]ethanone CAS Name: 1-[4-(4-fluoro-3-nitrophenyl)sulfonyl-1-piperazinyl]ethanone IUPAC Name: 1-[4-(4-fluoro-3-nitrophenyl)sulfonylpiperazin-1-yl]ethanone Traditional Name: 1-[4-(4-fluoro-3-nitro-phenyl)sulfonylpiperazino]ethanone Formula: C12H14FN3O5S MolecularWeight: 331.320063

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)F)[N+](=O)[O-]

InChI

InChI=1S/C12H14FN3O5S/c1-9(17)14-4-6-15(7-5-14)22(20,21)10-2-3-11(13)12(8-10)16(18)19/h2-3,8H,4-7H2,1H3