[4-[3-acetamido-2,5-dimethoxy-4-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxy-phenyl]phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[3-acetamido-2,5-dimethoxy-4-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxy-phenyl]phenyl]phenyl] methanesulfonate Openeye Name: [4-[3-acetamido-2,5-dimethoxy-4-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxy-phenyl]phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[3-acetamido-2,5-dimethoxy-4-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxyphenyl]phenyl]phenyl] ester IUPAC Name: [4-[3-acetamido-2,5-dimethoxy-4-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxyphenyl]phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[3-acetamido-2,5-dimethoxy-4-[4-(3-methylbut-2-enoxy)-3-methylsulfonyloxy-phenyl]phenyl]phenyl] ester Formula: C29H33NO10S2 MolecularWeight: 619.70302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2NC(=O)C)OC)C3=CC=C(C=C3)OS(=O)(=O)C)OC)OS(=O)(=O)C)C

Isomeric SMILES

CC(=CCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2NC(=O)C)OC)C3=CC=C(C=C3)OS(=O)(=O)C)OC)OS(=O)(=O)C)C

InChI

InChI=1S/C29H33NO10S2/c1-18(2)14-15-38-24-13-10-21(16-25(24)40-42(7,34)35)27-26(36-4)17-23(29(37-5)28(27)30-19(3)31)20-8-11-22(12-9-20)39-41(6,32)33/h8-14,16-17H,15H2,1-7H3,(H,30,31)