sodium 2-hexylbenzenesulfonate

Systemtic Name: sodium 2-hexylbenzenesulfonate Openeye Name: sodium 2-hexylbenzenesulfonate CAS Name: sodium 2-hexylbenzenesulfonate IUPAC Name: sodium 2-hexylbenzenesulfonate Traditional Name: sodium 2-hexylbesylate Formula: C12H17NaO3S MolecularWeight: 264.31635

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCC1=CC=CC=C1S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C12H18O3S.Na/c1-2-3-4-5-8-11-9-6-7-10-12(11)16(13,14)15;/h6-7,9-10H,2-5,8H2,1H3,(H,13,14,15);/q;+1/p-1