trifluoromethyl 4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-phenylmethoxy-phenyl)phenyl]-2-fluoranyl-benzenecarboximidate

Systemtic Name: trifluoromethyl 4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-phenylmethoxy-phenyl)phenyl]-2-fluoranyl-benzenecarboximidate Openeye Name: trifluoromethyl 4-[4-(4-benzyloxy-3-methylsulfonyloxy-phenyl)-2,5-dimethoxy-3-methylsulfonyloxy-phenyl]-2-fluoro-benzenecarboximidate CAS Name: 4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]-2-fluorobenzenecarboximidic acid trifluoromethyl ester IUPAC Name: trifluoromethyl 4-[2,5-dimethoxy-3-methylsulfonyloxy-4-(3-methylsulfonyloxy-4-phenylmethoxyphenyl)phenyl]-2-fluorobenzenecarboximidate Traditional Name: 4-[4-(4-benzoxy-3-methylsulfonyloxy-phenyl)-2,5-dimethoxy-3-methylsulfonyloxy-phenyl]-2-fluoro-benzenecarboximidic acid trifluoromethyl ester Formula: C31H27F4NO10S2 MolecularWeight: 713.670393

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C31H27F4NO10S2/c1-41-26-16-22(19-10-12-21(23(32)14-19)30(36)44-31(33,34)35)28(42-2)29(46-48(4,39)40)27(26)20-11-13-24(25(15-20)45-47(3,37)38)43-17-18-8-6-5-7-9-18/h5-16,36H,17H2,1-4H3