sodium 6-ethoxy-5-ethoxycarbonyl-6-oxidanylidene-hexane-1-sulfonic acid

Systemtic Name: sodium 6-ethoxy-5-ethoxycarbonyl-6-oxidanylidene-hexane-1-sulfonic acid Openeye Name: sodium 6-ethoxy-5-ethoxycarbonyl-6-oxo-hexane-1-sulfonic acid CAS Name: sodium 6-ethoxy-5-ethoxycarbonyl-6-oxo-1-hexanesulfonic acid IUPAC Name: sodium 6-ethoxy-5-ethoxycarbonyl-6-oxohexane-1-sulfonic acid Traditional Name: sodium 5-carbethoxy-6-ethoxy-6-keto-hexane-1-sulfonic acid Formula: C11H20NaO7S+ MolecularWeight: 319.32707

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCS(=O)(=O)O)C(=O)OCC.[Na+]

Isomeric SMILES

CCOC(=O)C(CCCCS(=O)(=O)O)C(=O)OCC.[Na+]

InChI

InChI=1S/C11H20O7S.Na/c1-3-17-10(12)9(11(13)18-4-2)7-5-6-8-19(14,15)16;/h9H,3-8H2,1-2H3,(H,14,15,16);/q;+1