oct-4-yn-3-yl methanesulfonate

Systemtic Name: oct-4-yn-3-yl methanesulfonate Openeye Name: 1-ethylhex-2-ynyl methanesulfonate CAS Name: methanesulfonic acid oct-4-yn-3-yl ester IUPAC Name: oct-4-yn-3-yl methanesulfonate Traditional Name: methanesulfonic acid 1-ethylhex-2-ynyl ester Formula: C9H16O3S MolecularWeight: 204.28654

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Descriptors Computed from Structure

Canonical SMILES:

CCCC#CC(CC)OS(=O)(=O)C

Isomeric SMILES

CCCC#CC(CC)OS(=O)(=O)C

InChI

InChI=1S/C9H16O3S/c1-4-6-7-8-9(5-2)12-13(3,10)11/h9H,4-6H2,1-3H3