3-[tert-butyl(diphenyl)silyl]oxy-4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-thiophen-2-yl-pyridin-3-yl]ethynyl-methoxy-phosphoryl]butanoic acid

Systemtic Name: 3-[tert-butyl(diphenyl)silyl]oxy-4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-thiophen-2-yl-pyridin-3-yl]ethynyl-methoxy-phosphoryl]butanoic acid Openeye Name: 3-[tert-butyl(diphenyl)silyl]oxy-4-[2-[4-(4-fluorophenyl)-2-isopropyl-6-(2-thienyl)-3-pyridyl]ethynyl-methoxy-phosphoryl]butanoic acid CAS Name: 3-[tert-butyl(diphenyl)silyl]oxy-4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-thiophen-2-yl-3-pyridinyl]ethynyl-methoxyphosphoryl]butanoic acid IUPAC Name: 3-[tert-butyl(diphenyl)silyl]oxy-4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-thiophen-2-ylpyridin-3-yl]ethynyl-methoxyphosphoryl]butanoic acid Traditional Name: 3-[tert-butyl(diphenyl)silyl]oxy-4-[2-[4-(4-fluorophenyl)-2-isopropyl-6-(2-thienyl)-3-pyridyl]ethynyl-methoxy-phosphoryl]butyric acid Formula: C41H43FNO5PSSi MolecularWeight: 739.906484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)F)C#CP(=O)(CC(CC(=O)O)O[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C(C)(C)C)OC

Isomeric SMILES

CC(C)C1=C(C(=CC(=N1)C2=CC=CS2)C3=CC=C(C=C3)F)C#CP(=O)(CC(CC(=O)O)O[Si](C4=CC=CC=C4)(C5=CC=CC=C5)C(C)(C)C)OC

InChI

InChI=1S/C41H43FNO5PSSi/c1-29(2)40-35(36(30-19-21-31(42)22-20-30)27-37(43-40)38-18-13-25-50-38)23-24-49(46,47-6)28-32(26-39(44)45)48-51(41(3,4)5,33-14-9-7-10-15-33)34-16-11-8-12-17-34/h7-22,25,27,29,32H,26,28H2,1-6H3,(H,44,45)