sodium 4-hexadecylsulfonylbenzenesulfonate

Systemtic Name: sodium 4-hexadecylsulfonylbenzenesulfonate Openeye Name: sodium 4-hexadecylsulfonylbenzenesulfonate CAS Name: sodium 4-hexadecylsulfonylbenzenesulfonate IUPAC Name: sodium 4-hexadecylsulfonylbenzenesulfonate Traditional Name: sodium 4-cetylsulfonylbesylate Formula: C22H37NaO5S2 MolecularWeight: 468.64595

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H38O5S2.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-28(23,24)21-16-18-22(19-17-21)29(25,26)27;/h16-19H,2-15,20H2,1H3,(H,25,26,27);/q;+1/p-1