sodium; ethyl prop-2-enoate; 2-methylprop-2-enoic acid; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate

Systemtic Name: sodium; ethyl prop-2-enoate; 2-methylprop-2-enoic acid; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate Openeye Name: sodium; ethyl prop-2-enoate; 2-methylprop-2-enoic acid; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate CAS Name: sodium; 2-methyl-2-(1-oxoprop-2-enylamino)-1-propanesulfonate; 2-methyl-2-propenoic acid; 2-propenoic acid ethyl ester IUPAC Name: sodium; ethyl prop-2-enoate; 2-methylprop-2-enoic acid; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate Traditional Name: sodium; 2-acrylamido-2-methyl-propane-1-sulfonate; acrylic acid ethyl ester; methacrylic acid Formula: C16H26NNaO8S MolecularWeight: 415.43431

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H13NO4S.C5H8O2.C4H6O2.Na/c1-4-6(9)8-7(2,3)5-13(10,11)12;1-3-5(6)7-4-2;1-3(2)4(5)6;/h4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);3H,1,4H2,2H3;1H2,2H3,(H,5,6);/q;;;+1/p-1