1,1,2,2,3,3,4,4,5,5,6,6,7,7,8-pentadecakis(fluoranyl)decyl 3-sulfooxypropanoate

Systemtic Name: 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8-pentadecakis(fluoranyl)decyl 3-sulfooxypropanoate Openeye Name: 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8-pentadecafluorodecyl 3-sulfooxypropanoate CAS Name: 3-sulfooxypropanoic acid 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8-pentadecafluorodecyl ester IUPAC Name: 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8-pentadecafluorodecyl 3-sulfooxypropanoate Traditional Name: 3-sulfoxypropionic acid 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8-pentadecafluorodecyl ester Formula: C13H11F15O6S MolecularWeight: 580.263888

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(C(C(C(C(C(C(OC(=O)CCOS(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F

Isomeric SMILES

CCC(C(C(C(C(C(C(C(OC(=O)CCOS(=O)(=O)O)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)F

InChI

InChI=1S/C13H11F15O6S/c1-2-5(14)7(15,16)8(17,18)9(19,20)10(21,22)11(23,24)12(25,26)13(27,28)34-6(29)3-4-33-35(30,31)32/h5H,2-4H2,1H3,(H,30,31,32)