2-(4-butan-2-ylsulfanylphenoxy)propyl methanesulfonate

Systemtic Name: 2-(4-butan-2-ylsulfanylphenoxy)propyl methanesulfonate Openeye Name: 2-(4-sec-butylsulfanylphenoxy)propyl methanesulfonate CAS Name: methanesulfonic acid 2-[4-(butan-2-ylthio)phenoxy]propyl ester IUPAC Name: 2-(4-butan-2-ylsulfanylphenoxy)propyl methanesulfonate Traditional Name: methanesulfonic acid 2-[4-(sec-butylthio)phenoxy]propyl ester Formula: C14H22O4S2 MolecularWeight: 318.45208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SC1=CC=C(C=C1)OC(C)COS(=O)(=O)C

Isomeric SMILES

CCC(C)SC1=CC=C(C=C1)OC(C)COS(=O)(=O)C

InChI

InChI=1S/C14H22O4S2/c1-5-12(3)19-14-8-6-13(7-9-14)18-11(2)10-17-20(4,15)16/h6-9,11-12H,5,10H2,1-4H3