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sodium 2,3-dihexadecyl-2-sulfo-butanedioate

sodium 2,3-dihexadecyl-2-sulfo-butanedioate

Systemtic Name:sodium 2,3-dihexadecyl-2-sulfo-butanedioate
Openeye Name:sodium 2,3-dihexadecyl-2-sulfo-butanedioate
CAS Name:sodium 2,3-dihexadecyl-2-sulfobutanedioate
IUPAC Name:sodium 2,3-dihexadecyl-2-sulfobutanedioate
Traditional Name:sodium 2,3-dicetyl-2-sulfo-succinate
Formula: C36H68NaO7S-
MolecularWeight: 667.97569
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C36H70O7S.Na/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33(34(37)38)36(35(39)40,44(41,42)43)32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;/h33H,3-32H2,1-2H3,(H,37,38)(H,39,40)(H,41,42,43);/q;+1/p-2


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