sodium 2-methyl-2-sulfanyl-propane-1-sulfonate

Systemtic Name: sodium 2-methyl-2-sulfanyl-propane-1-sulfonate Openeye Name: sodium 2-methyl-2-sulfanyl-propane-1-sulfonate CAS Name: sodium 2-mercapto-2-methyl-1-propanesulfonate IUPAC Name: sodium 2-methyl-2-sulfanylpropane-1-sulfonate Traditional Name: sodium 2-mercapto-2-methyl-propane-1-sulfonate Formula: C4H9NaO3S2 MolecularWeight: 192.23223

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C4H10O3S2.Na/c1-4(2,8)3-9(5,6)7;/h8H,3H2,1-2H3,(H,5,6,7);/q;+1/p-1