(4-butan-2-ylphenyl) methanesulfonate

Systemtic Name: (4-butan-2-ylphenyl) methanesulfonate Openeye Name: (4-sec-butylphenyl) methanesulfonate CAS Name: methanesulfonic acid (4-butan-2-ylphenyl) ester IUPAC Name: (4-butan-2-ylphenyl) methanesulfonate Traditional Name: methanesulfonic acid (4-sec-butylphenyl) ester Formula: C11H16O3S MolecularWeight: 228.30794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OS(=O)(=O)C

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OS(=O)(=O)C

InChI

InChI=1S/C11H16O3S/c1-4-9(2)10-5-7-11(8-6-10)14-15(3,12)13/h5-9H,4H2,1-3H3