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2-[6-(octanoylamino)hexanoyloxy]benzenesulfonate

2-[6-(octanoylamino)hexanoyloxy]benzenesulfonate

Systemtic Name:2-[6-(octanoylamino)hexanoyloxy]benzenesulfonate
Openeye Name:2-[6-(octanoylamino)hexanoyloxy]benzenesulfonate
CAS Name:2-[1-oxo-6-(1-oxooctylamino)hexoxy]benzenesulfonate
IUPAC Name:2-[6-(octanoylamino)hexanoyloxy]benzenesulfonate
Traditional Name:2-[6-(caprylylamino)hexanoyloxy]besylate
Formula: C20H30NO6S-
MolecularWeight: 412.5203
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NCCCCCC(=O)OC1=CC=CC=C1S(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCC(=O)NCCCCCC(=O)OC1=CC=CC=C1S(=O)(=O)[O-]


InChI

InChI=1S/C20H31NO6S/c1-2-3-4-5-7-14-19(22)21-16-11-6-8-15-20(23)27-17-12-9-10-13-18(17)28(24,25)26/h9-10,12-13H,2-8,11,14-16H2,1H3,(H,21,22)(H,24,25,26)/p-1


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