(1-oxidanyl-6-phenyl-hex-4-yn-2-yl) methanesulfonate

Systemtic Name: (1-oxidanyl-6-phenyl-hex-4-yn-2-yl) methanesulfonate Openeye Name: [1-(hydroxymethyl)-5-phenyl-pent-3-ynyl] methanesulfonate CAS Name: methanesulfonic acid (1-hydroxy-6-phenylhex-4-yn-2-yl) ester IUPAC Name: (1-hydroxy-6-phenylhex-4-yn-2-yl) methanesulfonate Traditional Name: methanesulfonic acid (1-methylol-5-phenyl-pent-3-ynyl) ester Formula: C13H16O4S MolecularWeight: 268.32874

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC(CC#CCC1=CC=CC=C1)CO

Isomeric SMILES

CS(=O)(=O)OC(CC#CCC1=CC=CC=C1)CO

InChI

InChI=1S/C13H16O4S/c1-18(15,16)17-13(11-14)10-6-5-9-12-7-3-2-4-8-12/h2-4,7-8,13-14H,9-11H2,1H3