methyl 2,5-dimethoxy-3-(4-methylsulfonyloxyphenyl)-6-(4-phenylmethoxyphenyl)benzoate

Systemtic Name: methyl 2,5-dimethoxy-3-(4-methylsulfonyloxyphenyl)-6-(4-phenylmethoxyphenyl)benzoate Openeye Name: methyl 2-(4-benzyloxyphenyl)-3,6-dimethoxy-5-(4-methylsulfonyloxyphenyl)benzoate CAS Name: 2,5-dimethoxy-3-(4-methylsulfonyloxyphenyl)-6-(4-phenylmethoxyphenyl)benzoic acid methyl ester IUPAC Name: methyl 2,5-dimethoxy-3-(4-methylsulfonyloxyphenyl)-6-(4-phenylmethoxyphenyl)benzoate Traditional Name: 2-(4-benzoxyphenyl)-3,6-dimethoxy-5-(4-methylsulfonyloxyphenyl)benzoic acid methyl ester Formula: C30H28O8S MolecularWeight: 548.60352

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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=C4

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=C4

InChI

InChI=1S/C30H28O8S/c1-34-26-18-25(21-10-16-24(17-11-21)38-39(4,32)33)29(35-2)28(30(31)36-3)27(26)22-12-14-23(15-13-22)37-19-20-8-6-5-7-9-20/h5-18H,19H2,1-4H3