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sodium 2-methyl-2-oxidanyl-3-oxidanylidene-tetracosanoate

sodium 2-methyl-2-oxidanyl-3-oxidanylidene-tetracosanoate

Systemtic Name:sodium 2-methyl-2-oxidanyl-3-oxidanylidene-tetracosanoate
Openeye Name:sodium 2-hydroxy-2-methyl-3-oxo-tetracosanoate
CAS Name:sodium 2-hydroxy-2-methyl-3-oxotetracosanoate
IUPAC Name:sodium 2-hydroxy-2-methyl-3-oxotetracosanoate
Traditional Name:sodium 2-hydroxy-3-keto-2-methyl-lignocerate
Formula: C25H47NaO4
MolecularWeight: 434.62805
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)C(C)(C(=O)[O-])O.[Na+]


Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)C(C)(C(=O)[O-])O.[Na+]


InChI

InChI=1S/C25H48O4.Na/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23(26)25(2,29)24(27)28;/h29H,3-22H2,1-2H3,(H,27,28);/q;+1/p-1


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