2-octyl-6-oxidanyl-benzenesulfonate

Systemtic Name: 2-octyl-6-oxidanyl-benzenesulfonate Openeye Name: 2-hydroxy-6-octyl-benzenesulfonate CAS Name: 2-hydroxy-6-octylbenzenesulfonate IUPAC Name: 2-hydroxy-6-octylbenzenesulfonate Traditional Name: 2-hydroxy-6-octyl-besylate Formula: C14H21O4S- MolecularWeight: 285.37914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C(=CC=C1)O)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCC1=C(C(=CC=C1)O)S(=O)(=O)[O-]

InChI

InChI=1S/C14H22O4S/c1-2-3-4-5-6-7-9-12-10-8-11-13(15)14(12)19(16,17)18/h8,10-11,15H,2-7,9H2,1H3,(H,16,17,18)/p-1