trisodium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; 2-oxidanyl-3-prop-2-enoxy-propane-1-sulfonate; prop-2-enoate

Systemtic Name: trisodium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; 2-oxidanyl-3-prop-2-enoxy-propane-1-sulfonate; prop-2-enoate Openeye Name: trisodium; 3-allyloxy-2-hydroxy-propane-1-sulfonate; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; prop-2-enoate CAS Name: trisodium; 2-hydroxy-3-prop-2-enoxy-1-propanesulfonate; 2-methyl-2-(1-oxoprop-2-enylamino)-1-propanesulfonate; 2-propenoate IUPAC Name: trisodium; 2-hydroxy-3-prop-2-enoxypropane-1-sulfonate; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; prop-2-enoate Traditional Name: trisodium; 2-acrylamido-2-methyl-propane-1-sulfonate; acrylate; 3-allyloxy-2-hydroxy-propane-1-sulfonate Formula: C16H26NNa3O11S2 MolecularWeight: 541.47705

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H13NO4S.C6H12O5S.C3H4O2.3Na/c1-4-6(9)8-7(2,3)5-13(10,11)12;1-2-3-11-4-6(7)5-12(8,9)10;1-2-3(4)5;;;/h4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);2,6-7H,1,3-5H2,(H,8,9,10);2H,1H2,(H,4,5);;;/q;;;3*+1/p-3