sodium 4-hexylbenzenesulfinate

Systemtic Name: sodium 4-hexylbenzenesulfinate Openeye Name: sodium 4-hexylbenzenesulfinate CAS Name: sodium 4-hexylbenzenesulfinate IUPAC Name: sodium 4-hexylbenzenesulfinate Traditional Name: sodium 4-hexylbenzenesulfinate Formula: C12H17NaO2S MolecularWeight: 248.31695

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)S(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)S(=O)[O-].[Na+]

InChI

InChI=1S/C12H18O2S.Na/c1-2-3-4-5-6-11-7-9-12(10-8-11)15(13)14;/h7-10H,2-6H2,1H3,(H,13,14);/q;+1/p-1