1-[3,3,4,4,5,5,6,6,7,7,8,8,8-tridecakis(fluoranyl)octan-2-ylsulfanylcarbonylamino]ethyl 2-methylprop-2-enoate

Systemtic Name: 1-[3,3,4,4,5,5,6,6,7,7,8,8,8-tridecakis(fluoranyl)octan-2-ylsulfanylcarbonylamino]ethyl 2-methylprop-2-enoate Openeye Name: 1-[(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-1-methyl-heptyl)sulfanylcarbonylamino]ethyl 2-methylprop-2-enoate CAS Name: 2-methyl-2-propenoic acid 1-[[oxo-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctan-2-ylthio)methyl]amino]ethyl ester IUPAC Name: 1-(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctan-2-ylsulfanylcarbonylamino)ethyl 2-methylprop-2-enoate Traditional Name: 2-methylacrylic acid 1-[[(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-1-methyl-heptyl)thio]carbonylamino]ethyl ester Formula: C15H14F13NO3S MolecularWeight: 535.320802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)SC(=O)NC(C)OC(=O)C(=C)C

Isomeric SMILES

CC(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)SC(=O)NC(C)OC(=O)C(=C)C

InChI

InChI=1S/C15H14F13NO3S/c1-5(2)8(30)32-7(4)29-9(31)33-6(3)10(16,17)11(18,19)12(20,21)13(22,23)14(24,25)15(26,27)28/h6-7H,1H2,2-4H3,(H,29,31)