3-[3-(dimethylamino)propyl-[1,1,2,2,3,3,4,4,5,5,6,6,6-tridecakis(fluoranyl)hexylsulfonyl]amino]-2-oxidanyl-propane-1-sulfonic acid

Systemtic Name: 3-[3-(dimethylamino)propyl-[1,1,2,2,3,3,4,4,5,5,6,6,6-tridecakis(fluoranyl)hexylsulfonyl]amino]-2-oxidanyl-propane-1-sulfonic acid Openeye Name: 3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxy-propane-1-sulfonic acid CAS Name: 3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxy-1-propanesulfonic acid IUPAC Name: 3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxypropane-1-sulfonic acid Traditional Name: 3-[3-(dimethylamino)propyl-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylsulfonyl)amino]-2-hydroxy-propane-1-sulfonic acid Formula: C14H19F13N2O6S2 MolecularWeight: 622.419702

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN(CC(CS(=O)(=O)O)O)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Isomeric SMILES

CN(C)CCCN(CC(CS(=O)(=O)O)O)S(=O)(=O)C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

InChI

InChI=1S/C14H19F13N2O6S2/c1-28(2)4-3-5-29(6-8(30)7-36(31,32)33)37(34,35)14(26,27)12(21,22)10(17,18)9(15,16)11(19,20)13(23,24)25/h8,30H,3-7H2,1-2H3,(H,31,32,33)