methyl 2-[3-fluoranyl-4-(pyridin-2-ylmethoxy)phenyl]-3,6-dimethoxy-5-(4-methylsulfonyloxyphenyl)benzoate

Systemtic Name: methyl 2-[3-fluoranyl-4-(pyridin-2-ylmethoxy)phenyl]-3,6-dimethoxy-5-(4-methylsulfonyloxyphenyl)benzoate Openeye Name: methyl 2-[3-fluoro-4-(2-pyridylmethoxy)phenyl]-3,6-dimethoxy-5-(4-methylsulfonyloxyphenyl)benzoate CAS Name: 2-[3-fluoro-4-(2-pyridinylmethoxy)phenyl]-3,6-dimethoxy-5-(4-methylsulfonyloxyphenyl)benzoic acid methyl ester IUPAC Name: methyl 2-[3-fluoro-4-(pyridin-2-ylmethoxy)phenyl]-3,6-dimethoxy-5-(4-methylsulfonyloxyphenyl)benzoate Traditional Name: 2-[3-fluoro-4-(2-pyridylmethoxy)phenyl]-3,6-dimethoxy-5-(4-methylsulfonyloxyphenyl)benzoic acid methyl ester Formula: C29H26FNO8S MolecularWeight: 567.582043

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)OC)C(=O)OC)C3=CC(=C(C=C3)OCC4=CC=CC=N4)F

Isomeric SMILES

COC1=C(C(=C(C(=C1)C2=CC=C(C=C2)OS(=O)(=O)C)OC)C(=O)OC)C3=CC(=C(C=C3)OCC4=CC=CC=N4)F

InChI

InChI=1S/C29H26FNO8S/c1-35-25-16-22(18-8-11-21(12-9-18)39-40(4,33)34)28(36-2)27(29(32)37-3)26(25)19-10-13-24(23(30)15-19)38-17-20-7-5-6-14-31-20/h5-16H,17H2,1-4H3