3-methylidene-2,2-bis[3,3,4,4,5,5,6,6,7,7,8,8,8-tridecakis(fluoranyl)octan-2-yl]butanedioate

Systemtic Name: 3-methylidene-2,2-bis[3,3,4,4,5,5,6,6,7,7,8,8,8-tridecakis(fluoranyl)octan-2-yl]butanedioate Openeye Name: 3-methylene-2,2-bis(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-1-methyl-heptyl)butanedioate CAS Name: 3-methylene-2,2-bis(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctan-2-yl)butanedioate IUPAC Name: 3-methylidene-2,2-bis(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctan-2-yl)butanedioate Traditional Name: 3-methylene-2,2-bis(2,2,3,3,4,4,5,5,6,6,7,7,7-tridecafluoro-1-methyl-heptyl)succinate Formula: C21H10F26O4-2 MolecularWeight: 820.260183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(C)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(=C)C(=O)[O-])C(=O)[O-])C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

CC(C(C(C)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(=C)C(=O)[O-])C(=O)[O-])C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C21H12F26O4/c1-4(7(48)49)9(8(50)51,5(2)10(22,23)12(26,27)14(30,31)16(34,35)18(38,39)20(42,43)44)6(3)11(24,25)13(28,29)15(32,33)17(36,37)19(40,41)21(45,46)47/h5-6H,1H2,2-3H3,(H,48,49)(H,50,51)/p-2