[2,3-bis(butylsulfonyloxy)phenyl] butane-1-sulfonate

Systemtic Name: [2,3-bis(butylsulfonyloxy)phenyl] butane-1-sulfonate Openeye Name: [2,3-bis(butylsulfonyloxy)phenyl] butane-1-sulfonate CAS Name: 1-butanesulfonic acid IUPAC Name: [2,3-bis(butylsulfonyloxy)phenyl] butane-1-sulfonate Traditional Name: butane-1-sulfonic acid [2,3-bis(butylsulfonyloxy)phenyl] ester Formula: C18H30O9S3 MolecularWeight: 486.6204

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)OC1=C(C(=CC=C1)OS(=O)(=O)CCCC)OS(=O)(=O)CCCC

Isomeric SMILES

CCCCS(=O)(=O)OC1=C(C(=CC=C1)OS(=O)(=O)CCCC)OS(=O)(=O)CCCC

InChI

InChI=1S/C18H30O9S3/c1-4-7-13-28(19,20)25-16-11-10-12-17(26-29(21,22)14-8-5-2)18(16)27-30(23,24)15-9-6-3/h10-12H,4-9,13-15H2,1-3H3