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sodium 4-oxidanylidene-4-pentoxy-3-sulfo-butanoate

sodium 4-oxidanylidene-4-pentoxy-3-sulfo-butanoate

Systemtic Name:sodium 4-oxidanylidene-4-pentoxy-3-sulfo-butanoate
Openeye Name:sodium 4-oxo-4-pentoxy-3-sulfo-butanoate
CAS Name:sodium 4-oxo-4-pentoxy-3-sulfobutanoate
IUPAC Name:sodium 4-oxo-4-pentoxy-3-sulfobutanoate
Traditional Name:sodium 4-amoxy-4-keto-3-sulfo-butyrate
Formula: C9H15NaO7S
MolecularWeight: 290.26597
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C9H16O7S.Na/c1-2-3-4-5-16-9(12)7(6-8(10)11)17(13,14)15;/h7H,2-6H2,1H3,(H,10,11)(H,13,14,15);/q;+1/p-1


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