trisodium 2-(2-ethylhexyl)-2-sulfonato-butanedioate

Systemtic Name: trisodium 2-(2-ethylhexyl)-2-sulfonato-butanedioate Openeye Name: trisodium 2-(2-ethylhexyl)-2-sulfonato-butanedioate CAS Name: trisodium 2-(2-ethylhexyl)-2-sulfonatobutanedioate IUPAC Name: trisodium 2-(2-ethylhexyl)-2-sulfonatobutanedioate Traditional Name: trisodium 2-(2-ethylhexyl)-2-sulfonato-succinate Formula: C12H19Na3O7S MolecularWeight: 376.30937

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

CCCCC(CC)CC(CC(=O)[O-])(C(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C12H22O7S.3Na/c1-3-5-6-9(4-2)7-12(11(15)16,8-10(13)14)20(17,18)19;;;/h9H,3-8H2,1-2H3,(H,13,14)(H,15,16)(H,17,18,19);;;/q;3*+1/p-3