[3-(2-methyl-1-oxidanyl-propan-2-yl)-4-oxidanyl-phenyl] methanesulfonate

Systemtic Name: [3-(2-methyl-1-oxidanyl-propan-2-yl)-4-oxidanyl-phenyl] methanesulfonate Openeye Name: [4-hydroxy-3-(2-hydroxy-1,1-dimethyl-ethyl)phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-hydroxy-3-(1-hydroxy-2-methylpropan-2-yl)phenyl] ester IUPAC Name: [4-hydroxy-3-(1-hydroxy-2-methylpropan-2-yl)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-hydroxy-3-(2-hydroxy-1,1-dimethyl-ethyl)phenyl] ester Formula: C11H16O5S MolecularWeight: 260.30674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O5S/c1-11(2,7-12)9-6-8(4-5-10(9)13)16-17(3,14)15/h4-6,12-13H,7H2,1-3H3