1-(4-chlorophenyl)sulfanylhexan-2-yl methanesulfonate

Systemtic Name: 1-(4-chlorophenyl)sulfanylhexan-2-yl methanesulfonate Openeye Name: 1-[(4-chlorophenyl)sulfanylmethyl]pentyl methanesulfonate CAS Name: methanesulfonic acid 1-[(4-chlorophenyl)thio]hexan-2-yl ester IUPAC Name: 1-(4-chlorophenyl)sulfanylhexan-2-yl methanesulfonate Traditional Name: methanesulfonic acid 1-[[(4-chlorophenyl)thio]methyl]pentyl ester Formula: C13H19ClO3S2 MolecularWeight: 322.87116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CSC1=CC=C(C=C1)Cl)OS(=O)(=O)C

Isomeric SMILES

CCCCC(CSC1=CC=C(C=C1)Cl)OS(=O)(=O)C

InChI

InChI=1S/C13H19ClO3S2/c1-3-4-5-12(17-19(2,15)16)10-18-13-8-6-11(14)7-9-13/h6-9,12H,3-5,10H2,1-2H3