(8-ethylsulfanyl-6-fluoranyl-3,4-dihydro-2H-chromen-2-yl)methyl methanesulfonate

Systemtic Name: (8-ethylsulfanyl-6-fluoranyl-3,4-dihydro-2H-chromen-2-yl)methyl methanesulfonate Openeye Name: (8-ethylsulfanyl-6-fluoro-chroman-2-yl)methyl methanesulfonate CAS Name: methanesulfonic acid [8-(ethylthio)-6-fluoro-3,4-dihydro-2H-1-benzopyran-2-yl]methyl ester IUPAC Name: (8-ethylsulfanyl-6-fluoro-3,4-dihydro-2H-chromen-2-yl)methyl methanesulfonate Traditional Name: methanesulfonic acid [8-(ethylthio)-6-fluoro-chroman-2-yl]methyl ester Formula: C13H17FO4S2 MolecularWeight: 320.400083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=C2C(=CC(=C1)F)CCC(O2)COS(=O)(=O)C

Isomeric SMILES

CCSC1=C2C(=CC(=C1)F)CCC(O2)COS(=O)(=O)C

InChI

InChI=1S/C13H17FO4S2/c1-3-19-12-7-10(14)6-9-4-5-11(18-13(9)12)8-17-20(2,15)16/h6-7,11H,3-5,8H2,1-2H3