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The molecular formula is C14H23NaO7S.
The molecular weight is 358.38 g/mol.
The IUPAC name is sodium; 1-cyclohexyloxy-4-(2-methylpropoxy)-1,4-dioxobutane-2-sulfonate.
The InChI code is InChI=1S/C14H24O7S.Na/c1-10(2)9-20-13(15)8-12(22(17,18)19)14(16)21-11-6-4-3-5-7-11;/h10-12H,3-9H2,1-2H3,(H,17,18,19);/q;+1/p-1.
The Canonical SMILES representation is CC(C)COC(=O)CC(C(=O)OC1CCCCC1)S(=O)(=O)[O-].[Na+].
The CAS number is 97158-41-3.
There are 0 hydrogen bond donor counts.
There are 7 hydrogen bond acceptor counts.
The topological polar surface area is 118 Ų.
Yes, the compound is canonicalized.
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97158-47-9
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