sodium 2-(2-methylidenehexanoyloxy)ethanesulfonate

Systemtic Name: sodium 2-(2-methylidenehexanoyloxy)ethanesulfonate Openeye Name: sodium 2-(2-methylenehexanoyloxy)ethanesulfonate CAS Name: sodium 2-(2-methylene-1-oxohexoxy)ethanesulfonate IUPAC Name: sodium 2-(2-methylidenehexanoyloxy)ethanesulfonate Traditional Name: sodium 2-(2-butylacryloyl)oxyethanesulfonate Formula: C9H15NaO5S MolecularWeight: 258.26717

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C)C(=O)OCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCC(=C)C(=O)OCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C9H16O5S.Na/c1-3-4-5-8(2)9(10)14-6-7-15(11,12)13;/h2-7H2,1H3,(H,11,12,13);/q;+1/p-1