disodium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; propan-2-olate; prop-2-enoic acid

Systemtic Name: disodium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; propan-2-olate; prop-2-enoic acid Openeye Name: disodium; acrylic acid; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; propan-2-olate CAS Name: disodium; 2-methyl-2-(1-oxoprop-2-enylamino)-1-propanesulfonate; 2-propanolate; 2-propenoic acid IUPAC Name: disodium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; propan-2-olate; prop-2-enoic acid Traditional Name: disodium; 2-acrylamido-2-methyl-propane-1-sulfonate; acrylic acid; propan-2-olate Formula: C13H23NNa2O7S MolecularWeight: 383.36876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H13NO4S.C3H4O2.C3H7O.2Na/c1-4-6(9)8-7(2,3)5-13(10,11)12;1-2-3(4)5;1-3(2)4;;/h4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);2H,1H2,(H,4,5);3H,1-2H3;;/q;;-1;2*+1/p-1