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2-[2-(nonanoylamino)hexanoyloxy]benzenesulfonate

2-[2-(nonanoylamino)hexanoyloxy]benzenesulfonate

Systemtic Name:2-[2-(nonanoylamino)hexanoyloxy]benzenesulfonate
Openeye Name:2-[2-(nonanoylamino)hexanoyloxy]benzenesulfonate
CAS Name:2-[1-oxo-2-(1-oxononylamino)hexoxy]benzenesulfonate
IUPAC Name:2-[2-(nonanoylamino)hexanoyloxy]benzenesulfonate
Traditional Name:2-[2-(pelargonylamino)hexanoyloxy]besylate
Formula: C21H32NO6S-
MolecularWeight: 426.54688
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NC(CCCC)C(=O)OC1=CC=CC=C1S(=O)(=O)[O-]


Isomeric SMILES

CCCCCCCCC(=O)NC(CCCC)C(=O)OC1=CC=CC=C1S(=O)(=O)[O-]


InChI

InChI=1S/C21H33NO6S/c1-3-5-7-8-9-10-16-20(23)22-17(13-6-4-2)21(24)28-18-14-11-12-15-19(18)29(25,26)27/h11-12,14-15,17H,3-10,13,16H2,1-2H3,(H,22,23)(H,25,26,27)/p-1


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