ethyl (Z)-3-(ethylamino)-4,4,5,5,6,6,7,7,8,8,9,9,9-tridecakis(fluoranyl)non-2-enoate

Systemtic Name: ethyl (Z)-3-(ethylamino)-4,4,5,5,6,6,7,7,8,8,9,9,9-tridecakis(fluoranyl)non-2-enoate Openeye Name: ethyl (Z)-3-(ethylamino)-4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-non-2-enoate CAS Name: (Z)-3-(ethylamino)-4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-2-nonenoic acid ethyl ester IUPAC Name: ethyl (Z)-3-(ethylamino)-4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoronon-2-enoate Traditional Name: (Z)-3-(ethylamino)-4,4,5,5,6,6,7,7,8,8,9,9,9-tridecafluoro-non-2-enoic acid ethyl ester Formula: C13H12F13NO2 MolecularWeight: 461.219122

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=CC(=O)OCC)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

CCN/C(=C\C(=O)OCC)/C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C13H12F13NO2/c1-3-27-6(5-7(28)29-4-2)8(14,15)9(16,17)10(18,19)11(20,21)12(22,23)13(24,25)26/h5,27H,3-4H2,1-2H3/b6-5-