2,2,2-tris(fluoranyl)-1-[4-(3-nitro-4-oxidanyl-phenyl)piperazin-1-yl]ethanone

Systemtic Name: 2,2,2-tris(fluoranyl)-1-[4-(3-nitro-4-oxidanyl-phenyl)piperazin-1-yl]ethanone Openeye Name: 2,2,2-trifluoro-1-[4-(4-hydroxy-3-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 2,2,2-trifluoro-1-[4-(4-hydroxy-3-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2,2,2-trifluoro-1-[4-(4-hydroxy-3-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2,2,2-trifluoro-1-[4-(4-hydroxy-3-nitro-phenyl)piperazino]ethanone Formula: C12H12F3N3O4 MolecularWeight: 319.23659

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)O)[N+](=O)[O-])C(=O)C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)O)[N+](=O)[O-])C(=O)C(F)(F)F

InChI

InChI=1S/C12H12F3N3O4/c13-12(14,15)11(20)17-5-3-16(4-6-17)8-1-2-10(19)9(7-8)18(21)22/h1-2,7,19H,3-6H2