4-hexadecylsulfonylbenzenesulfonic acid

Systemtic Name: 4-hexadecylsulfonylbenzenesulfonic acid Openeye Name: 4-hexadecylsulfonylbenzenesulfonic acid CAS Name: 4-hexadecylsulfonylbenzenesulfonic acid IUPAC Name: 4-hexadecylsulfonylbenzenesulfonic acid Traditional Name: 4-cetylsulfonylbesylic acid Formula: C22H38O5S2 MolecularWeight: 446.66412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCS(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C22H38O5S2/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)