4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-pyridin-2-yl-pyridin-3-yl]ethynyl-oxidanyl-phosphoryl]-3-oxidanyl-butanoic acid

Systemtic Name: 4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-pyridin-2-yl-pyridin-3-yl]ethynyl-oxidanyl-phosphoryl]-3-oxidanyl-butanoic acid Openeye Name: 4-[2-[4-(4-fluorophenyl)-2-isopropyl-6-(2-pyridyl)-3-pyridyl]ethynyl-hydroxy-phosphoryl]-3-hydroxy-butanoic acid CAS Name: 4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-(2-pyridinyl)-3-pyridinyl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid IUPAC Name: 4-[2-[4-(4-fluorophenyl)-2-propan-2-yl-6-pyridin-2-ylpyridin-3-yl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid Traditional Name: 4-[2-[4-(4-fluorophenyl)-2-isopropyl-6-(2-pyridyl)-3-pyridyl]ethynyl-hydroxy-phosphoryl]-3-hydroxy-butyric acid Formula: C25H24FN2O5P MolecularWeight: 482.440624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC(=N1)C2=CC=CC=N2)C3=CC=C(C=C3)F)C#CP(=O)(CC(CC(=O)O)O)O

Isomeric SMILES

CC(C)C1=C(C(=CC(=N1)C2=CC=CC=N2)C3=CC=C(C=C3)F)C#CP(=O)(CC(CC(=O)O)O)O

InChI

InChI=1S/C25H24FN2O5P/c1-16(2)25-20(10-12-34(32,33)15-19(29)13-24(30)31)21(17-6-8-18(26)9-7-17)14-23(28-25)22-5-3-4-11-27-22/h3-9,11,14,16,19,29H,13,15H2,1-2H3,(H,30,31)(H,32,33)