[1-oxidanyl-2-(4-phenylbutoxy)ethyl] methanesulfonate

Systemtic Name: [1-oxidanyl-2-(4-phenylbutoxy)ethyl] methanesulfonate Openeye Name: [1-hydroxy-2-(4-phenylbutoxy)ethyl] methanesulfonate CAS Name: methanesulfonic acid [1-hydroxy-2-(4-phenylbutoxy)ethyl] ester IUPAC Name: [1-hydroxy-2-(4-phenylbutoxy)ethyl] methanesulfonate Traditional Name: methanesulfonic acid [1-hydroxy-2-(4-phenylbutoxy)ethyl] ester Formula: C13H20O5S MolecularWeight: 288.3599

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(COCCCCC1=CC=CC=C1)O

Isomeric SMILES

CS(=O)(=O)OC(COCCCCC1=CC=CC=C1)O

InChI

InChI=1S/C13H20O5S/c1-19(15,16)18-13(14)11-17-10-6-5-9-12-7-3-2-4-8-12/h2-4,7-8,13-14H,5-6,9-11H2,1H3