sodium; (E)-2-methylbut-2-enamide; (E)-2-phenylethenesulfonate

Systemtic Name: sodium; (E)-2-methylbut-2-enamide; (E)-2-phenylethenesulfonate Openeye Name: sodium; (E)-2-methylbut-2-enamide; (E)-2-phenylethenesulfonate CAS Name: sodium; (E)-2-methyl-2-butenamide; (E)-2-phenylethenesulfonate IUPAC Name: sodium; (E)-2-methylbut-2-enamide; (E)-2-phenylethenesulfonate Traditional Name: sodium; (E)-2-methylbut-2-enamide; (E)-2-phenylethenesulfonate Formula: C13H16NNaO4S MolecularWeight: 305.32521

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C=C(\C)/C(=O)N.C1=CC=C(C=C1)/C=C/S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C8H8O3S.C5H9NO.Na/c9-12(10,11)7-6-8-4-2-1-3-5-8;1-3-4(2)5(6)7;/h1-7H,(H,9,10,11);3H,1-2H3,(H2,6,7);/q;;+1/p-1/b7-6+;4-3+;