sodium 4-(2,2-dimethylpropanoyloxy)benzenesulfonate

Systemtic Name: sodium 4-(2,2-dimethylpropanoyloxy)benzenesulfonate Openeye Name: sodium 4-(2,2-dimethylpropanoyloxy)benzenesulfonate CAS Name: sodium 4-(2,2-dimethyl-1-oxopropoxy)benzenesulfonate IUPAC Name: sodium 4-(2,2-dimethylpropanoyloxy)benzenesulfonate Traditional Name: sodium 4-pivaloyloxybesylate Formula: C11H13NaO5S MolecularWeight: 280.27269

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC=C(C=C1)S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H14O5S.Na/c1-11(2,3)10(12)16-8-4-6-9(7-5-8)17(13,14)15;/h4-7H,1-3H3,(H,13,14,15);/q;+1/p-1