[5-[4-(1H-indol-5-yl)-3,6-dimethoxy-2-methylsulfonyloxy-phenyl]-2-(3-methylbut-2-enoxy)phenyl] methanesulfonate

Systemtic Name: [5-[4-(1H-indol-5-yl)-3,6-dimethoxy-2-methylsulfonyloxy-phenyl]-2-(3-methylbut-2-enoxy)phenyl] methanesulfonate Openeye Name: [5-[4-(1H-indol-5-yl)-3,6-dimethoxy-2-methylsulfonyloxy-phenyl]-2-(3-methylbut-2-enoxy)phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[4-(1H-indol-5-yl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] ester IUPAC Name: [5-[4-(1H-indol-5-yl)-3,6-dimethoxy-2-methylsulfonyloxyphenyl]-2-(3-methylbut-2-enoxy)phenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[4-(1H-indol-5-yl)-3,6-dimethoxy-2-methylsulfonyloxy-phenyl]-2-(3-methylbut-2-enoxy)phenyl] ester Formula: C29H31NO9S2 MolecularWeight: 601.68774

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2OS(=O)(=O)C)OC)C3=CC4=C(C=C3)NC=C4)OC)OS(=O)(=O)C)C

Isomeric SMILES

CC(=CCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2OS(=O)(=O)C)OC)C3=CC4=C(C=C3)NC=C4)OC)OS(=O)(=O)C)C

InChI

InChI=1S/C29H31NO9S2/c1-18(2)12-14-37-24-10-8-21(16-25(24)38-40(5,31)32)27-26(35-3)17-22(28(36-4)29(27)39-41(6,33)34)19-7-9-23-20(15-19)11-13-30-23/h7-13,15-17,30H,14H2,1-6H3