4-[6-(nonanoylamino)hexanoyloxy]benzenesulfonate

Systemtic Name: 4-[6-(nonanoylamino)hexanoyloxy]benzenesulfonate Openeye Name: 4-[6-(nonanoylamino)hexanoyloxy]benzenesulfonate CAS Name: 4-[1-oxo-6-(1-oxononylamino)hexoxy]benzenesulfonate IUPAC Name: 4-[6-(nonanoylamino)hexanoyloxy]benzenesulfonate Traditional Name: 4-[6-(pelargonylamino)hexanoyloxy]besylate Formula: C21H32NO6S- MolecularWeight: 426.54688

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)NCCCCCC(=O)OC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCC(=O)NCCCCCC(=O)OC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C21H33NO6S/c1-2-3-4-5-6-8-11-20(23)22-17-10-7-9-12-21(24)28-18-13-15-19(16-14-18)29(25,26)27/h13-16H,2-12,17H2,1H3,(H,22,23)(H,25,26,27)/p-1