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disodium [3-(sulfonatomethyl)phenyl]methanesulfonate

disodium [3-(sulfonatomethyl)phenyl]methanesulfonate

Systemtic Name:disodium [3-(sulfonatomethyl)phenyl]methanesulfonate
Openeye Name:disodium [3-(sulfonatomethyl)phenyl]methanesulfonate
CAS Name:disodium [3-(sulfonatomethyl)phenyl]methanesulfonate
IUPAC Name:disodium [3-(sulfonatomethyl)phenyl]methanesulfonate
Traditional Name:disodium [3-(sulfonatomethyl)phenyl]methanesulfonate
Formula: C8H8Na2O6S2
MolecularWeight: 310.25506
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CS(=O)(=O)[O-])CS(=O)(=O)[O-].[Na+].[Na+]


Isomeric SMILES

C1=CC(=CC(=C1)CS(=O)(=O)[O-])CS(=O)(=O)[O-].[Na+].[Na+]


InChI

InChI=1S/C8H10O6S2.2Na/c9-15(10,11)5-7-2-1-3-8(4-7)6-16(12,13)14;;/h1-4H,5-6H2,(H,9,10,11)(H,12,13,14);;/q;2*+1/p-2


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