(2,6-ditert-butyl-4-methoxy-phenyl) 3-fluoranyl-2-phenyl-benzoate

Systemtic Name: (2,6-ditert-butyl-4-methoxy-phenyl) 3-fluoranyl-2-phenyl-benzoate Openeye Name: (2,6-ditert-butyl-4-methoxy-phenyl) 3-fluoro-2-phenyl-benzoate CAS Name: 3-fluoro-2-phenylbenzoic acid (2,6-ditert-butyl-4-methoxyphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-methoxyphenyl) 3-fluoro-2-phenylbenzoate Traditional Name: 3-fluoro-2-phenyl-benzoic acid (2,6-ditert-butyl-4-methoxy-phenyl) ester Formula: C28H31FO3 MolecularWeight: 434.542343

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1OC(=O)C2=C(C(=CC=C2)F)C3=CC=CC=C3)C(C)(C)C)OC

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1OC(=O)C2=C(C(=CC=C2)F)C3=CC=CC=C3)C(C)(C)C)OC

InChI

InChI=1S/C28H31FO3/c1-27(2,3)21-16-19(31-7)17-22(28(4,5)6)25(21)32-26(30)20-14-11-15-23(29)24(20)18-12-9-8-10-13-18/h8-17H,1-7H3