sodium 3-[3-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecanoylamino]propyl-methyl-amino]propanoate

Systemtic Name: sodium 3-[3-[4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecakis(fluoranyl)undecanoylamino]propyl-methyl-amino]propanoate Openeye Name: sodium 3-[3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecanoylamino)propyl-methyl-amino]propanoate CAS Name: sodium 3-[3-[(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-1-oxoundecyl)amino]propyl-methylamino]propanoate IUPAC Name: sodium 3-[3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecanoylamino)propyl-methylamino]propanoate Traditional Name: sodium 3-[3-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecanoylamino)propyl-methyl-amino]propionate Formula: C18H18F17N2NaO3 MolecularWeight: 656.309744

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCC(=O)[O-].[Na+]

Isomeric SMILES

CN(CCCNC(=O)CCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)CCC(=O)[O-].[Na+]

InChI

InChI=1S/C18H19F17N2O3.Na/c1-37(8-4-10(39)40)7-2-6-36-9(38)3-5-11(19,20)12(21,22)13(23,24)14(25,26)15(27,28)16(29,30)17(31,32)18(33,34)35;/h2-8H2,1H3,(H,36,38)(H,39,40);/q;+1/p-1