sodium 3-(2-ethylhexoxy)-3-oxidanylidene-propane-1-sulfonate

Systemtic Name: sodium 3-(2-ethylhexoxy)-3-oxidanylidene-propane-1-sulfonate Openeye Name: sodium 3-(2-ethylhexoxy)-3-oxo-propane-1-sulfonate CAS Name: sodium 3-(2-ethylhexoxy)-3-oxo-1-propanesulfonate IUPAC Name: sodium 3-(2-ethylhexoxy)-3-oxopropane-1-sulfonate Traditional Name: sodium 3-(2-ethylhexoxy)-3-keto-propane-1-sulfonate Formula: C11H21NaO5S MolecularWeight: 288.33621

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)CCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCC(CC)COC(=O)CCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H22O5S.Na/c1-3-5-6-10(4-2)9-16-11(12)7-8-17(13,14)15;/h10H,3-9H2,1-2H3,(H,13,14,15);/q;+1/p-1