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

Systemtic Name: [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-(quinolin-2-ylmethoxy)phenyl]phenyl]phenyl] methanesulfonate Openeye Name: [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-(2-quinolylmethoxy)phenyl]phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-(2-quinolinylmethoxy)phenyl]phenyl]phenyl] ester IUPAC Name: [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-(quinolin-2-ylmethoxy)phenyl]phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[2,5-dimethoxy-3-methylsulfonyloxy-4-[3-methylsulfonyloxy-4-(2-quinolylmethoxy)phenyl]phenyl]phenyl] ester Formula: C33H31NO12S3 MolecularWeight: 729.79374

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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)OCC4=NC5=CC=CC=C5C=C4)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)OCC4=NC5=CC=CC=C5C=C4)OS(=O)(=O)C

InChI

InChI=1S/C33H31NO12S3/c1-41-30-19-26(21-11-15-25(16-12-21)44-47(3,35)36)32(42-2)33(46-49(5,39)40)31(30)23-13-17-28(29(18-23)45-48(4,37)38)43-20-24-14-10-22-8-6-7-9-27(22)34-24/h6-19H,20H2,1-5H3