sodium 2-(2-octyldodecyl)benzenesulfonate

Systemtic Name: sodium 2-(2-octyldodecyl)benzenesulfonate Openeye Name: sodium 2-(2-octyldodecyl)benzenesulfonate CAS Name: sodium 2-(2-octyldodecyl)benzenesulfonate IUPAC Name: sodium 2-(2-octyldodecyl)benzenesulfonate Traditional Name: sodium 2-(2-octyldodecyl)besylate Formula: C26H45NaO3S MolecularWeight: 460.68847

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(CCCCCCCC)CC1=CC=CC=C1S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCC(CCCCCCCC)CC1=CC=CC=C1S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C26H46O3S.Na/c1-3-5-7-9-11-12-14-16-20-24(19-15-13-10-8-6-4-2)23-25-21-17-18-22-26(25)30(27,28)29;/h17-18,21-22,24H,3-16,19-20,23H2,1-2H3,(H,27,28,29);/q;+1/p-1