phenacyl methanesulfonate

Systemtic Name: phenacyl methanesulfonate Openeye Name: phenacyl methanesulfonate CAS Name: methanesulfonic acid phenacyl ester IUPAC Name: phenacyl methanesulfonate Traditional Name: methanesulfonic acid phenacyl ester Formula: C9H10O4S MolecularWeight: 214.2383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCC(=O)C1=CC=CC=C1

Isomeric SMILES

CS(=O)(=O)OCC(=O)C1=CC=CC=C1

InChI

InChI=1S/C9H10O4S/c1-14(11,12)13-7-9(10)8-5-3-2-4-6-8/h2-6H,7H2,1H3