iodanium 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate

Systemtic Name: iodanium 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate Openeye Name: iodonium 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate CAS Name: iodonium 2-methyl-2-(1-oxoprop-2-enylamino)-1-propanesulfonate IUPAC Name: iodanium 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate Traditional Name: iodonium 2-acrylamido-2-methyl-propane-1-sulfonate Formula: C7H14INO4S MolecularWeight: 335.15983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.[IH2+]

Isomeric SMILES

CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.[IH2+]

InChI

InChI=1S/C7H13NO4S.H2I/c1-4-6(9)8-7(2,3)5-13(10,11)12;/h4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);1H2/q;+1/p-1