7,8-bis(phenylsulfonyloxy)octyl benzenesulfonate

Systemtic Name: 7,8-bis(phenylsulfonyloxy)octyl benzenesulfonate Openeye Name: 7,8-bis(benzenesulfonyloxy)octyl benzenesulfonate CAS Name: benzenesulfonic acid 7,8-bis(benzenesulfonyloxy)octyl ester IUPAC Name: 7,8-bis(benzenesulfonyloxy)octyl benzenesulfonate Traditional Name: benzenesulfonic acid 7,8-dibesyloxyoctyl ester Formula: C26H30O9S3 MolecularWeight: 582.706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)OCCCCCCC(COS(=O)(=O)C2=CC=CC=C2)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)OCCCCCCC(COS(=O)(=O)C2=CC=CC=C2)OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H30O9S3/c27-36(28,24-15-7-3-8-16-24)33-21-13-2-1-6-14-23(35-38(31,32)26-19-11-5-12-20-26)22-34-37(29,30)25-17-9-4-10-18-25/h3-5,7-12,15-20,23H,1-2,6,13-14,21-22H2