[4-[2,5-dimethoxy-4-[3-methylsulfonyloxy-4-(pyridin-2-ylmethoxy)phenyl]phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[2,5-dimethoxy-4-[3-methylsulfonyloxy-4-(pyridin-2-ylmethoxy)phenyl]phenyl]phenyl] methanesulfonate Openeye Name: [4-[2,5-dimethoxy-4-[3-methylsulfonyloxy-4-(2-pyridylmethoxy)phenyl]phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2,5-dimethoxy-4-[3-methylsulfonyloxy-4-(2-pyridinylmethoxy)phenyl]phenyl]phenyl] ester IUPAC Name: [4-[2,5-dimethoxy-4-[3-methylsulfonyloxy-4-(pyridin-2-ylmethoxy)phenyl]phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[2,5-dimethoxy-4-[3-methylsulfonyloxy-4-(2-pyridylmethoxy)phenyl]phenyl]phenyl] ester Formula: C28H27NO9S2 MolecularWeight: 585.64528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC(=C(C=C3)OCC4=CC=CC=N4)OS(=O)(=O)C

Isomeric SMILES

COC1=CC(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC(=C(C=C3)OCC4=CC=CC=N4)OS(=O)(=O)C

InChI

InChI=1S/C28H27NO9S2/c1-34-26-17-24(27(35-2)16-23(26)19-8-11-22(12-9-19)37-39(3,30)31)20-10-13-25(28(15-20)38-40(4,32)33)36-18-21-7-5-6-14-29-21/h5-17H,18H2,1-4H3