methyl 3-(4-fluorophenyl)-2,5-dimethoxy-6-(3-methylsulfonyloxy-4-phenylmethoxy-phenyl)benzoate

Systemtic Name: methyl 3-(4-fluorophenyl)-2,5-dimethoxy-6-(3-methylsulfonyloxy-4-phenylmethoxy-phenyl)benzoate Openeye Name: methyl 2-(4-benzyloxy-3-methylsulfonyloxy-phenyl)-5-(4-fluorophenyl)-3,6-dimethoxy-benzoate CAS Name: 3-(4-fluorophenyl)-2,5-dimethoxy-6-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)benzoic acid methyl ester IUPAC Name: methyl 3-(4-fluorophenyl)-2,5-dimethoxy-6-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)benzoate Traditional Name: 2-(4-benzoxy-3-methylsulfonyloxy-phenyl)-5-(4-fluorophenyl)-3,6-dimethoxy-benzoic acid methyl ester Formula: C30H27FO8S MolecularWeight: 566.593983

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C(=C1)C2=CC=C(C=C2)F)OC)C(=O)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OS(=O)(=O)C

Isomeric SMILES

COC1=C(C(=C(C(=C1)C2=CC=C(C=C2)F)OC)C(=O)OC)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OS(=O)(=O)C

InChI

InChI=1S/C30H27FO8S/c1-35-26-17-23(20-10-13-22(31)14-11-20)29(36-2)28(30(32)37-3)27(26)21-12-15-24(25(16-21)39-40(4,33)34)38-18-19-8-6-5-7-9-19/h5-17H,18H2,1-4H3