[4-[4-(3-fluoranyl-4-phenylmethoxy-phenyl)-5-methoxy-2-(methoxymethoxy)-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate

Systemtic Name: [4-[4-(3-fluoranyl-4-phenylmethoxy-phenyl)-5-methoxy-2-(methoxymethoxy)-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate Openeye Name: [4-[4-(4-benzyloxy-3-fluoro-phenyl)-5-methoxy-2-(methoxymethoxy)-3-methylsulfonyloxy-phenyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[4-(3-fluoro-4-phenylmethoxyphenyl)-5-methoxy-2-(methoxymethoxy)-3-methylsulfonyloxyphenyl]phenyl] ester IUPAC Name: [4-[4-(3-fluoro-4-phenylmethoxyphenyl)-5-methoxy-2-(methoxymethoxy)-3-methylsulfonyloxyphenyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[4-(4-benzoxy-3-fluoro-phenyl)-5-methoxy-2-(methoxymethoxy)-3-methylsulfonyloxy-phenyl]phenyl] ester Formula: C30H29FO10S2 MolecularWeight: 632.673663

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1=C(C(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)F)OS(=O)(=O)C

Isomeric SMILES

COCOC1=C(C(=C(C=C1C2=CC=C(C=C2)OS(=O)(=O)C)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)F)OS(=O)(=O)C

InChI

InChI=1S/C30H29FO10S2/c1-36-19-39-29-24(21-10-13-23(14-11-21)40-42(3,32)33)17-27(37-2)28(30(29)41-43(4,34)35)22-12-15-26(25(31)16-22)38-18-20-8-6-5-7-9-20/h5-17H,18-19H2,1-4H3