sodium 2-(5-methylhexyl)benzenesulfonate

Systemtic Name: sodium 2-(5-methylhexyl)benzenesulfonate Openeye Name: sodium 2-(5-methylhexyl)benzenesulfonate CAS Name: sodium 2-(5-methylhexyl)benzenesulfonate IUPAC Name: sodium 2-(5-methylhexyl)benzenesulfonate Traditional Name: sodium 2-(5-methylhexyl)besylate Formula: C13H19NaO3S MolecularWeight: 278.34293

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCC1=CC=CC=C1S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CC(C)CCCCC1=CC=CC=C1S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C13H20O3S.Na/c1-11(2)7-3-4-8-12-9-5-6-10-13(12)17(14,15)16;/h5-6,9-11H,3-4,7-8H2,1-2H3,(H,14,15,16);/q;+1/p-1