1,3-bis[3,4,5-tris(trifluoromethyl)phenyl]propan-2-one

Systemtic Name: 1,3-bis[3,4,5-tris(trifluoromethyl)phenyl]propan-2-one Openeye Name: 1,3-bis[3,4,5-tris(trifluoromethyl)phenyl]propan-2-one CAS Name: 1,3-bis[3,4,5-tris(trifluoromethyl)phenyl]-2-propanone IUPAC Name: 1,3-bis[3,4,5-tris(trifluoromethyl)phenyl]propan-2-one Traditional Name: 1,3-bis[3,4,5-tris(trifluoromethyl)phenyl]acetone Formula: C21H8F18O MolecularWeight: 618.258878

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1C(F)(F)F)C(F)(F)F)C(F)(F)F)CC(=O)CC2=CC(=C(C(=C2)C(F)(F)F)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1C(F)(F)F)C(F)(F)F)C(F)(F)F)CC(=O)CC2=CC(=C(C(=C2)C(F)(F)F)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C21H8F18O/c22-16(23,24)10-3-7(4-11(17(25,26)27)14(10)20(34,35)36)1-9(40)2-8-5-12(18(28,29)30)15(21(37,38)39)13(6-8)19(31,32)33/h3-6H,1-2H2