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

Systemtic Name: 4-[2-[2-(4-fluorophenyl)-4-propan-2-yl-quinolin-3-yl]ethynyl-oxidanyl-phosphoryl]-3-oxidanyl-butanoic acid Openeye Name: 4-[2-[2-(4-fluorophenyl)-4-isopropyl-3-quinolyl]ethynyl-hydroxy-phosphoryl]-3-hydroxy-butanoic acid CAS Name: 4-[2-[2-(4-fluorophenyl)-4-propan-2-yl-3-quinolinyl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid IUPAC Name: 4-[2-[2-(4-fluorophenyl)-4-propan-2-ylquinolin-3-yl]ethynyl-hydroxyphosphoryl]-3-hydroxybutanoic acid Traditional Name: 4-[2-[2-(4-fluorophenyl)-4-isopropyl-3-quinolyl]ethynyl-hydroxy-phosphoryl]-3-hydroxy-butyric acid Formula: C24H23FNO5P MolecularWeight: 455.415284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)F)C#CP(=O)(CC(CC(=O)O)O)O

Isomeric SMILES

CC(C)C1=C(C(=NC2=CC=CC=C21)C3=CC=C(C=C3)F)C#CP(=O)(CC(CC(=O)O)O)O

InChI

InChI=1S/C24H23FNO5P/c1-15(2)23-19-5-3-4-6-21(19)26-24(16-7-9-17(25)10-8-16)20(23)11-12-32(30,31)14-18(27)13-22(28)29/h3-10,15,18,27H,13-14H2,1-2H3,(H,28,29)(H,30,31)