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sodium 3-sulfohexanedioate

sodium 3-sulfohexanedioate

Systemtic Name:sodium 3-sulfohexanedioate
Openeye Name:sodium 3-sulfohexanedioate
CAS Name:sodium 3-sulfohexanedioate
IUPAC Name:sodium 3-sulfohexanedioate
Traditional Name:sodium 3-sulfoadipate
Formula: C6H8NaO7S-
MolecularWeight: 247.17829
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C6H10O7S.Na/c7-5(8)2-1-4(3-6(9)10)14(11,12)13;/h4H,1-3H2,(H,7,8)(H,9,10)(H,11,12,13);/q;+1/p-2


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