sodium 2-methyl-1-oxidanyl-undecane-1-sulfonate

Systemtic Name: sodium 2-methyl-1-oxidanyl-undecane-1-sulfonate Openeye Name: sodium 1-hydroxy-2-methyl-undecane-1-sulfonate CAS Name: sodium 1-hydroxy-2-methyl-1-undecanesulfonate IUPAC Name: sodium 1-hydroxy-2-methylundecane-1-sulfonate Traditional Name: sodium 1-hydroxy-2-methyl-undecane-1-sulfonate Formula: C12H25NaO4S MolecularWeight: 288.37927

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H26O4S.Na/c1-3-4-5-6-7-8-9-10-11(2)12(13)17(14,15)16;/h11-13H,3-10H2,1-2H3,(H,14,15,16);/q;+1/p-1