2,2-bis(chloranyl)ethanoic acid; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonic acid

Systemtic Name: 2,2-bis(chloranyl)ethanoic acid; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonic acid Openeye Name: 2,2-dichloroacetic acid; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonic acid CAS Name: 2,2-dichloroacetic acid; 2-methyl-2-(1-oxoprop-2-enylamino)-1-propanesulfonic acid IUPAC Name: 2,2-dichloroacetic acid; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonic acid Traditional Name: 2-acrylamido-2-methyl-propane-1-sulfonic acid; 2,2-dichloroacetic acid Formula: C9H15Cl2NO6S MolecularWeight: 336.1895

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS(=O)(=O)O)NC(=O)C=C.C(C(=O)O)(Cl)Cl

Isomeric SMILES

CC(C)(CS(=O)(=O)O)NC(=O)C=C.C(C(=O)O)(Cl)Cl

InChI

InChI=1S/C7H13NO4S.C2H2Cl2O2/c1-4-6(9)8-7(2,3)5-13(10,11)12;3-1(4)2(5)6/h4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);1H,(H,5,6)