2-[4-[1-(3,5-ditert-butyl-4-methoxy-phenyl)ethyl]-2-fluoranyl-phenyl]ethanoic acid

Systemtic Name: 2-[4-[1-(3,5-ditert-butyl-4-methoxy-phenyl)ethyl]-2-fluoranyl-phenyl]ethanoic acid Openeye Name: 2-[4-[1-(3,5-ditert-butyl-4-methoxy-phenyl)ethyl]-2-fluoro-phenyl]acetic acid CAS Name: 2-[4-[1-(3,5-ditert-butyl-4-methoxyphenyl)ethyl]-2-fluorophenyl]acetic acid IUPAC Name: 2-[4-[1-(3,5-ditert-butyl-4-methoxyphenyl)ethyl]-2-fluorophenyl]acetic acid Traditional Name: 2-[4-[1-(3,5-ditert-butyl-4-methoxy-phenyl)ethyl]-2-fluoro-phenyl]acetic acid Formula: C25H33FO3 MolecularWeight: 400.526123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H33FO3/c1-15(16-9-10-17(14-22(27)28)21(26)13-16)18-11-19(24(2,3)4)23(29-8)20(12-18)25(5,6)7/h9-13,15H,14H2,1-8H3,(H,27,28)