2-docosylbenzenesulfonic acid

Systemtic Name: 2-docosylbenzenesulfonic acid Openeye Name: 2-docosylbenzenesulfonic acid CAS Name: 2-docosylbenzenesulfonic acid IUPAC Name: 2-docosylbenzenesulfonic acid Traditional Name: 2-behenylbesylic acid Formula: C28H50O3S MolecularWeight: 466.7598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)O

InChI

InChI=1S/C28H50O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-24-27-25-22-23-26-28(27)32(29,30)31/h22-23,25-26H,2-21,24H2,1H3,(H,29,30,31)