sodium 5,10-diethyl-8-(2-ethylhexoxycarbonyl)-8-(2-ethylhexyl)-7-sulfooxycarbonyl-tetradecane-7-sulfonic acid

Systemtic Name: sodium 5,10-diethyl-8-(2-ethylhexoxycarbonyl)-8-(2-ethylhexyl)-7-sulfooxycarbonyl-tetradecane-7-sulfonic acid Openeye Name: sodium 5,10-diethyl-8-(2-ethylhexoxycarbonyl)-8-(2-ethylhexyl)-7-sulfooxycarbonyl-tetradecane-7-sulfonic acid CAS Name: sodium 5,10-diethyl-8-[2-ethylhexoxy(oxo)methyl]-8-(2-ethylhexyl)-7-[oxo(sulfooxy)methyl]-7-tetradecanesulfonic acid IUPAC Name: sodium 5,10-diethyl-8-(2-ethylhexoxycarbonyl)-8-(2-ethylhexyl)-7-sulfooxycarbonyltetradecane-7-sulfonic acid Traditional Name: sodium 5,10-diethyl-8-(2-ethylhexoxycarbonyl)-8-(2-ethylhexyl)-7-sulfoxycarbonyl-tetradecane-7-sulfonic acid Formula: C36H70NaO10S2+ MolecularWeight: 750.05477

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(CC(CC)CCCC)(C(=O)OCC(CC)CCCC)C(CC(CC)CCCC)(C(=O)OS(=O)(=O)O)S(=O)(=O)O.[Na+]

Isomeric SMILES

CCCCC(CC)CC(CC(CC)CCCC)(C(=O)OCC(CC)CCCC)C(CC(CC)CCCC)(C(=O)OS(=O)(=O)O)S(=O)(=O)O.[Na+]

InChI

InChI=1S/C36H70O10S2.Na/c1-9-17-21-29(13-5)25-35(26-30(14-6)22-18-10-2,33(37)45-28-32(16-8)24-20-12-4)36(47(39,40)41,34(38)46-48(42,43)44)27-31(15-7)23-19-11-3;/h29-32H,9-28H2,1-8H3,(H,39,40,41)(H,42,43,44);/q;+1