4,4,4-tris(fluoranyl)-1-(4-nitrophenyl)-3-oxidanyl-3-(trifluoromethyl)butan-1-one

Systemtic Name: 4,4,4-tris(fluoranyl)-1-(4-nitrophenyl)-3-oxidanyl-3-(trifluoromethyl)butan-1-one Openeye Name: 4,4,4-trifluoro-3-hydroxy-1-(4-nitrophenyl)-3-(trifluoromethyl)butan-1-one CAS Name: 4,4,4-trifluoro-3-hydroxy-1-(4-nitrophenyl)-3-(trifluoromethyl)-1-butanone IUPAC Name: 4,4,4-trifluoro-3-hydroxy-1-(4-nitrophenyl)-3-(trifluoromethyl)butan-1-one Traditional Name: 4,4,4-trifluoro-3-hydroxy-1-(4-nitrophenyl)-3-(trifluoromethyl)butan-1-one Formula: C11H7F6NO4 MolecularWeight: 331.167999

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)CC(C(F)(F)F)(C(F)(F)F)O)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)CC(C(F)(F)F)(C(F)(F)F)O)[N+](=O)[O-]

InChI

InChI=1S/C11H7F6NO4/c12-10(13,14)9(20,11(15,16)17)5-8(19)6-1-3-7(4-2-6)18(21)22/h1-4,20H,5H2