[2-(4-chloranylbut-2-ynoxy)-3,3-dimethyl-2H-1-benzofuran-5-yl] methanesulfonate

Systemtic Name: [2-(4-chloranylbut-2-ynoxy)-3,3-dimethyl-2H-1-benzofuran-5-yl] methanesulfonate Openeye Name: [2-(4-chlorobut-2-ynoxy)-3,3-dimethyl-2H-benzofuran-5-yl] methanesulfonate CAS Name: methanesulfonic acid [2-(4-chlorobut-2-ynoxy)-3,3-dimethyl-2H-benzofuran-5-yl] ester IUPAC Name: [2-(4-chlorobut-2-ynoxy)-3,3-dimethyl-2H-1-benzofuran-5-yl] methanesulfonate Traditional Name: methanesulfonic acid [2-(4-chlorobut-2-ynoxy)-3,3-dimethyl-coumaran-5-yl] ester Formula: C15H17ClO5S MolecularWeight: 344.81048

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(OC2=C1C=C(C=C2)OS(=O)(=O)C)OCC#CCCl)C

Isomeric SMILES

CC1(C(OC2=C1C=C(C=C2)OS(=O)(=O)C)OCC#CCCl)C

InChI

InChI=1S/C15H17ClO5S/c1-15(2)12-10-11(21-22(3,17)18)6-7-13(12)20-14(15)19-9-5-4-8-16/h6-7,10,14H,8-9H2,1-3H3