2-[(3R)-2-ethanoyl-5-(2-fluoranyl-5-methyl-phenyl)-3-phenyl-4H-pyrazol-3-yl]ethyl dihydrogen phosphate

Systemtic Name: 2-[(3R)-2-ethanoyl-5-(2-fluoranyl-5-methyl-phenyl)-3-phenyl-4H-pyrazol-3-yl]ethyl dihydrogen phosphate Openeye Name: 2-[(3R)-2-acetyl-5-(2-fluoro-5-methyl-phenyl)-3-phenyl-4H-pyrazol-3-yl]ethyl dihydrogen phosphate CAS Name: 2-[(3R)-2-acetyl-5-(2-fluoro-5-methylphenyl)-3-phenyl-4H-pyrazol-3-yl]ethyl dihydrogen phosphate IUPAC Name: 2-[(3R)-2-acetyl-5-(2-fluoro-5-methylphenyl)-3-phenyl-4H-pyrazol-3-yl]ethyl dihydrogen phosphate Traditional Name: 2-[(3R)-2-acetyl-5-(2-fluoro-5-methyl-phenyl)-3-phenyl-2-pyrazolin-3-yl]ethyl dihydrogen phosphate Formula: C20H22FN2O5P MolecularWeight: 420.371244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)F)C2=NN(C(C2)(CCOP(=O)(O)O)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)F)C2=NN([C@](C2)(CCOP(=O)(O)O)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C20H22FN2O5P/c1-14-8-9-18(21)17(12-14)19-13-20(23(22-19)15(2)24,10-11-28-29(25,26)27)16-6-4-3-5-7-16/h3-9,12H,10-11,13H2,1-2H3,(H2,25,26,27)/t20-/m0/s1