[3-methyl-3-(2-methylsulfonyloxy-5-phenylmethoxy-phenyl)butyl] methanesulfonate

Systemtic Name: [3-methyl-3-(2-methylsulfonyloxy-5-phenylmethoxy-phenyl)butyl] methanesulfonate Openeye Name: [3-(5-benzyloxy-2-methylsulfonyloxy-phenyl)-3-methyl-butyl] methanesulfonate CAS Name: methanesulfonic acid [3-methyl-3-(2-methylsulfonyloxy-5-phenylmethoxyphenyl)butyl] ester IUPAC Name: [3-methyl-3-(2-methylsulfonyloxy-5-phenylmethoxyphenyl)butyl] methanesulfonate Traditional Name: methanesulfonic acid [3-(5-benzoxy-2-methylsulfonyloxy-phenyl)-3-methyl-butyl] ester Formula: C20H26O7S2 MolecularWeight: 442.54624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCOS(=O)(=O)C)C1=C(C=CC(=C1)OCC2=CC=CC=C2)OS(=O)(=O)C

Isomeric SMILES

CC(C)(CCOS(=O)(=O)C)C1=C(C=CC(=C1)OCC2=CC=CC=C2)OS(=O)(=O)C

InChI

InChI=1S/C20H26O7S2/c1-20(2,12-13-26-28(3,21)22)18-14-17(10-11-19(18)27-29(4,23)24)25-15-16-8-6-5-7-9-16/h5-11,14H,12-13,15H2,1-4H3