[4-[2-ethoxy-5-methoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxy-phenyl]-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[2-ethoxy-5-methoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxy-phenyl]-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate Openeye Name: [4-[2-ethoxy-5-methoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxy-phenyl]-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[2-ethoxy-5-methoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxyphenyl]-3-methylsulfonyloxyphenyl]phenyl] ester IUPAC Name: [4-[2-ethoxy-5-methoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxyphenyl]-3-methylsulfonyloxyphenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[2-ethoxy-5-methoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxy-phenyl]-3-methylsulfonyloxy-phenyl]phenyl] ester Formula: C30H36O12S3 MolecularWeight: 684.79464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC(=C(C=C3)OCCC=C(C)C)OS(=O)(=O)C)OS(=O)(=O)C

Isomeric SMILES

CCOC1=C(C(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC(=C(C=C3)OCCC=C(C)C)OS(=O)(=O)C)OS(=O)(=O)C

InChI

InChI=1S/C30H36O12S3/c1-8-38-29-24(21-11-14-23(15-12-21)40-43(5,31)32)19-27(37-4)28(30(29)42-45(7,35)36)22-13-16-25(39-17-9-10-20(2)3)26(18-22)41-44(6,33)34/h10-16,18-19H,8-9,17H2,1-7H3