ethyl 2-[6-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-4,4-bis(trifluoromethyl)-1,3,5-oxadiazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[6-[1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]-4,4-bis(trifluoromethyl)-1,3,5-oxadiazin-2-yl]ethanoate Openeye Name: ethyl 2-[4,4-bis(trifluoromethyl)-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-1,3,5-oxadiazin-2-yl]acetate CAS Name: 2-[6-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4,4-bis(trifluoromethyl)-1,3,5-oxadiazin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-(1,1,1,3,3,3-hexafluoropropan-2-yl)-4,4-bis(trifluoromethyl)-1,3,5-oxadiazin-2-yl]acetate Traditional Name: 2-[4,4-bis(trifluoromethyl)-6-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-1,3,5-oxadiazin-2-yl]acetic acid ethyl ester Formula: C12H8F12N2O3 MolecularWeight: 456.184358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=NC(N=C(O1)C(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)CC1=NC(N=C(O1)C(C(F)(F)F)C(F)(F)F)(C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C12H8F12N2O3/c1-2-28-5(27)3-4-25-10(11(19,20)21,12(22,23)24)26-7(29-4)6(8(13,14)15)9(16,17)18/h6H,2-3H2,1H3