sodium; (E)-3-(3-ethenyl-2-oxidanylidene-pyrrolidin-1-yl)prop-2-enamide; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate

Systemtic Name: sodium; (E)-3-(3-ethenyl-2-oxidanylidene-pyrrolidin-1-yl)prop-2-enamide; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate Openeye Name: sodium; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate; (E)-3-(2-oxo-3-vinyl-pyrrolidin-1-yl)prop-2-enamide CAS Name: sodium; (E)-3-(3-ethenyl-2-oxo-1-pyrrolidinyl)-2-propenamide; 2-methyl-2-(1-oxoprop-2-enylamino)-1-propanesulfonate IUPAC Name: sodium; (E)-3-(3-ethenyl-2-oxopyrrolidin-1-yl)prop-2-enamide; 2-methyl-2-(prop-2-enoylamino)propane-1-sulfonate Traditional Name: sodium; 2-acrylamido-2-methyl-propane-1-sulfonate; (E)-3-(2-keto-3-vinyl-pyrrolidino)acrylamide Formula: C16H24N3NaO6S MolecularWeight: 409.43303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.C=CC1CCN(C1=O)C=CC(=O)N.[Na+]

Isomeric SMILES

CC(C)(CS(=O)(=O)[O-])NC(=O)C=C.C=CC1CCN(C1=O)/C=C/C(=O)N.[Na+]

InChI

InChI=1S/C9H12N2O2.C7H13NO4S.Na/c1-2-7-3-5-11(9(7)13)6-4-8(10)12;1-4-6(9)8-7(2,3)5-13(10,11)12;/h2,4,6-7H,1,3,5H2,(H2,10,12);4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);/q;;+1/p-1/b6-4+;;