[4-[3-azanyl-2,5-dimethoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxy-phenyl]phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[3-azanyl-2,5-dimethoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxy-phenyl]phenyl]phenyl] methanesulfonate Openeye Name: [4-[3-amino-2,5-dimethoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxy-phenyl]phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[3-amino-2,5-dimethoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxyphenyl]phenyl]phenyl] ester IUPAC Name: [4-[3-amino-2,5-dimethoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxyphenyl]phenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[3-amino-2,5-dimethoxy-4-[4-(4-methylpent-3-enoxy)-3-methylsulfonyloxy-phenyl]phenyl]phenyl] ester Formula: C28H33NO9S2 MolecularWeight: 591.69292

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2N)OC)C3=CC=C(C=C3)OS(=O)(=O)C)OC)OS(=O)(=O)C)C

Isomeric SMILES

CC(=CCCOC1=C(C=C(C=C1)C2=C(C=C(C(=C2N)OC)C3=CC=C(C=C3)OS(=O)(=O)C)OC)OS(=O)(=O)C)C

InChI

InChI=1S/C28H33NO9S2/c1-18(2)8-7-15-36-23-14-11-20(16-24(23)38-40(6,32)33)26-25(34-3)17-22(28(35-4)27(26)29)19-9-12-21(13-10-19)37-39(5,30)31/h8-14,16-17H,7,15,29H2,1-6H3