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2-octylbenzenesulfonate

2-octylbenzenesulfonate

Systemtic Name:2-octylbenzenesulfonate
Openeye Name:2-octylbenzenesulfonate
CAS Name:2-octylbenzenesulfonate
IUPAC Name:2-octylbenzenesulfonate
Traditional Name:2-octylbesylate
Formula: C14H21O3S-
MolecularWeight: 269.37974
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-]


InChI

InChI=1S/C14H22O3S/c1-2-3-4-5-6-7-10-13-11-8-9-12-14(13)18(15,16)17/h8-9,11-12H,2-7,10H2,1H3,(H,15,16,17)/p-1


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