[3-(4-hydroxyphenyl)-2,5-dimethoxy-6-[4-(3-methylbut-2-enoxy)-3-oxidanyl-phenyl]phenyl] methanesulfonate

Systemtic Name: [3-(4-hydroxyphenyl)-2,5-dimethoxy-6-[4-(3-methylbut-2-enoxy)-3-oxidanyl-phenyl]phenyl] methanesulfonate Openeye Name: [2-[3-hydroxy-4-(3-methylbut-2-enoxy)phenyl]-5-(4-hydroxyphenyl)-3,6-dimethoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [2-[3-hydroxy-4-(3-methylbut-2-enoxy)phenyl]-5-(4-hydroxyphenyl)-3,6-dimethoxyphenyl] ester IUPAC Name: [2-[3-hydroxy-4-(3-methylbut-2-enoxy)phenyl]-5-(4-hydroxyphenyl)-3,6-dimethoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-[3-hydroxy-4-(3-methylbut-2-enoxy)phenyl]-5-(4-hydroxyphenyl)-3,6-dimethoxy-phenyl] ester Formula: C26H28O8S MolecularWeight: 500.56072

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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=CC=C(C=C3)O)OC)O)C

Isomeric SMILES

CC(=CCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2OS(=O)(=O)C)OC)C3=CC=C(C=C3)O)OC)O)C

InChI

InChI=1S/C26H28O8S/c1-16(2)12-13-33-22-11-8-18(14-21(22)28)24-23(31-3)15-20(17-6-9-19(27)10-7-17)25(32-4)26(24)34-35(5,29)30/h6-12,14-15,27-28H,13H2,1-5H3