1-(4-chloranyl-3-nitro-phenyl)-4,4,4-tris(fluoranyl)-3-(trifluoromethyl)but-2-en-1-one

Systemtic Name: 1-(4-chloranyl-3-nitro-phenyl)-4,4,4-tris(fluoranyl)-3-(trifluoromethyl)but-2-en-1-one Openeye Name: 1-(4-chloro-3-nitro-phenyl)-4,4,4-trifluoro-3-(trifluoromethyl)but-2-en-1-one CAS Name: 1-(4-chloro-3-nitrophenyl)-4,4,4-trifluoro-3-(trifluoromethyl)-2-buten-1-one IUPAC Name: 1-(4-chloro-3-nitrophenyl)-4,4,4-trifluoro-3-(trifluoromethyl)but-2-en-1-one Traditional Name: 1-(4-chloro-3-nitro-phenyl)-4,4,4-trifluoro-3-(trifluoromethyl)but-2-en-1-one Formula: C11H4ClF6NO3 MolecularWeight: 347.597779

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H4ClF6NO3/c12-6-2-1-5(3-7(6)19(21)22)8(20)4-9(10(13,14)15)11(16,17)18/h1-4H