tert-butyl 3,5-bis(phenylmethoxy)-4-[2-phenylmethoxy-6-(trifluoromethylsulfonylamino)phenyl]carbonyl-benzoate

Systemtic Name: tert-butyl 3,5-bis(phenylmethoxy)-4-[2-phenylmethoxy-6-(trifluoromethylsulfonylamino)phenyl]carbonyl-benzoate Openeye Name: tert-butyl 3,5-dibenzyloxy-4-[2-benzyloxy-6-(trifluoromethylsulfonylamino)benzoyl]benzoate CAS Name: 4-[oxo-[2-phenylmethoxy-6-(trifluoromethylsulfonylamino)phenyl]methyl]-3,5-bis(phenylmethoxy)benzoic acid tert-butyl ester IUPAC Name: tert-butyl 3,5-bis(phenylmethoxy)-4-[2-phenylmethoxy-6-(trifluoromethylsulfonylamino)benzoyl]benzoate Traditional Name: 3,5-dibenzoxy-4-[2-benzoxy-6-(triflylamino)benzoyl]benzoic acid tert-butyl ester Formula: C40H36F3NO8S MolecularWeight: 747.77595

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)NS(=O)(=O)C(F)(F)F)OCC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC(=C(C(=C1)OCC2=CC=CC=C2)C(=O)C3=C(C=CC=C3OCC4=CC=CC=C4)NS(=O)(=O)C(F)(F)F)OCC5=CC=CC=C5

InChI

InChI=1S/C40H36F3NO8S/c1-39(2,3)52-38(46)30-22-33(50-25-28-16-9-5-10-17-28)36(34(23-30)51-26-29-18-11-6-12-19-29)37(45)35-31(44-53(47,48)40(41,42)43)20-13-21-32(35)49-24-27-14-7-4-8-15-27/h4-23,44H,24-26H2,1-3H3