(2-cyano-4,5-diethoxy-3-fluoranyl-phenyl)methyl methanesulfonate

Systemtic Name: (2-cyano-4,5-diethoxy-3-fluoranyl-phenyl)methyl methanesulfonate Openeye Name: (2-cyano-4,5-diethoxy-3-fluoro-phenyl)methyl methanesulfonate CAS Name: methanesulfonic acid (2-cyano-4,5-diethoxy-3-fluorophenyl)methyl ester IUPAC Name: (2-cyano-4,5-diethoxy-3-fluorophenyl)methyl methanesulfonate Traditional Name: methanesulfonic acid (2-cyano-4,5-diethoxy-3-fluoro-benzyl) ester Formula: C13H16FNO5S MolecularWeight: 317.333243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C(=C1)COS(=O)(=O)C)C#N)F)OCC

Isomeric SMILES

CCOC1=C(C(=C(C(=C1)COS(=O)(=O)C)C#N)F)OCC

InChI

InChI=1S/C13H16FNO5S/c1-4-18-11-6-9(8-20-21(3,16)17)10(7-15)12(14)13(11)19-5-2/h6H,4-5,8H2,1-3H3