[4-[5-methyl-6-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxy-phenyl]pyridin-3-yl]phenyl] methanesulfonate

Systemtic Name: [4-[5-methyl-6-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxy-phenyl]pyridin-3-yl]phenyl] methanesulfonate Openeye Name: [4-[5-methyl-6-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxy-phenyl]-3-pyridyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[5-methyl-6-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxyphenyl]-3-pyridinyl]phenyl] ester IUPAC Name: [4-[5-methyl-6-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxyphenyl]pyridin-3-yl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[5-methyl-6-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxy-phenyl]-3-pyridyl]phenyl] ester Formula: C25H27NO7S2 MolecularWeight: 517.61438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)C3=CC(=C(C=C3)OCC=C(C)C)OS(=O)(=O)C

Isomeric SMILES

CC1=C(N=CC(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)C3=CC(=C(C=C3)OCC=C(C)C)OS(=O)(=O)C

InChI

InChI=1S/C25H27NO7S2/c1-17(2)12-13-31-23-11-8-20(15-24(23)33-35(5,29)30)25-18(3)14-21(16-26-25)19-6-9-22(10-7-19)32-34(4,27)28/h6-12,14-16H,13H2,1-5H3