[5,5,5-tris(fluoranyl)-1-phenylmethoxy-pent-3-yn-2-yl] methanesulfonate

Systemtic Name: [5,5,5-tris(fluoranyl)-1-phenylmethoxy-pent-3-yn-2-yl] methanesulfonate Openeye Name: [1-(benzyloxymethyl)-4,4,4-trifluoro-but-2-ynyl] methanesulfonate CAS Name: methanesulfonic acid (5,5,5-trifluoro-1-phenylmethoxypent-3-yn-2-yl) ester IUPAC Name: (5,5,5-trifluoro-1-phenylmethoxypent-3-yn-2-yl) methanesulfonate Traditional Name: methanesulfonic acid [1-(benzoxymethyl)-4,4,4-trifluoro-but-2-ynyl] ester Formula: C13H13F3O4S MolecularWeight: 322.30013

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(COCC1=CC=CC=C1)C#CC(F)(F)F

Isomeric SMILES

CS(=O)(=O)OC(COCC1=CC=CC=C1)C#CC(F)(F)F

InChI

InChI=1S/C13H13F3O4S/c1-21(17,18)20-12(7-8-13(14,15)16)10-19-9-11-5-3-2-4-6-11/h2-6,12H,9-10H2,1H3