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

Systemtic Name: [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-(2-pyridin-2-ylethoxy)phenyl]phenyl]phenyl] methanesulfonate Openeye Name: [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-[2-(2-pyridyl)ethoxy]phenyl]phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-[2-(2-pyridinyl)ethoxy]phenyl]phenyl]phenyl] ester IUPAC Name: [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-(2-pyridin-2-ylethoxy)phenyl]phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-[2-(2-pyridyl)ethoxy]phenyl]phenyl]phenyl] ester Formula: C30H31NO12S3 MolecularWeight: 693.76164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)OC)OS(=O)(=O)C)C3=CC(=C(C=C3)OCCC4=CC=CC=N4)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C(=C(C(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)OC)OS(=O)(=O)C)C3=CC(=C(C=C3)OCCC4=CC=CC=N4)OS(=O)(=O)C

InChI

InChI=1S/C30H31NO12S3/c1-38-27-19-24(20-9-12-23(13-10-20)41-44(3,32)33)29(39-2)30(43-46(5,36)37)28(27)21-11-14-25(26(18-21)42-45(4,34)35)40-17-15-22-8-6-7-16-31-22/h6-14,16,18-19H,15,17H2,1-5H3