sodium 2-[[(E)-but-2-enoyl]amino]-2-methyl-propane-1-sulfonate

Systemtic Name: sodium 2-[[(E)-but-2-enoyl]amino]-2-methyl-propane-1-sulfonate Openeye Name: sodium 2-[[(E)-but-2-enoyl]amino]-2-methyl-propane-1-sulfonate CAS Name: sodium 2-methyl-2-[[(E)-1-oxobut-2-enyl]amino]-1-propanesulfonate IUPAC Name: sodium 2-[[(E)-but-2-enoyl]amino]-2-methylpropane-1-sulfonate Traditional Name: sodium 2-[[(E)-but-2-enoyl]amino]-2-methyl-propane-1-sulfonate Formula: C8H14NNaO4S MolecularWeight: 243.25583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15NO4S.Na/c1-4-5-7(10)9-8(2,3)6-14(11,12)13;/h4-5H,6H2,1-3H3,(H,9,10)(H,11,12,13);/q;+1/p-1/b5-4+;