sodium 4-(2-methylbutan-2-yl)benzenesulfinate

Systemtic Name: sodium 4-(2-methylbutan-2-yl)benzenesulfinate Openeye Name: sodium 4-(1,1-dimethylpropyl)benzenesulfinate CAS Name: sodium 4-(2-methylbutan-2-yl)benzenesulfinate IUPAC Name: sodium 4-(2-methylbutan-2-yl)benzenesulfinate Traditional Name: sodium 4-tert-amylbenzenesulfinate Formula: C11H15NaO2S MolecularWeight: 234.29037

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O2S.Na/c1-4-11(2,3)9-5-7-10(8-6-9)14(12)13;/h5-8H,4H2,1-3H3,(H,12,13);/q;+1/p-1