sodium 1,4-bis(2-methylbutoxy)-1,4-bis(oxidanylidene)butane-2-sulfonate

Systemtic Name: sodium 1,4-bis(2-methylbutoxy)-1,4-bis(oxidanylidene)butane-2-sulfonate Openeye Name: sodium 1,4-bis(2-methylbutoxy)-1,4-dioxo-butane-2-sulfonate CAS Name: sodium 1,4-bis(2-methylbutoxy)-1,4-dioxo-2-butanesulfonate IUPAC Name: sodium 1,4-bis(2-methylbutoxy)-1,4-dioxobutane-2-sulfonate Traditional Name: sodium 1,4-diketo-1,4-bis(2-methylbutoxy)butane-2-sulfonate Formula: C14H25NaO7S MolecularWeight: 360.39887

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)COC(=O)CC(C(=O)OCC(C)CC)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCC(C)COC(=O)CC(C(=O)OCC(C)CC)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C14H26O7S.Na/c1-5-10(3)8-20-13(15)7-12(22(17,18)19)14(16)21-9-11(4)6-2;/h10-12H,5-9H2,1-4H3,(H,17,18,19);/q;+1/p-1