[3-(2-fluoranyl-4-methyl-phenyl)-1-(triphenylmethyl)pyrazol-4-yl]boronic acid

Systemtic Name: [3-(2-fluoranyl-4-methyl-phenyl)-1-(triphenylmethyl)pyrazol-4-yl]boronic acid Openeye Name: [3-(2-fluoro-4-methyl-phenyl)-1-trityl-pyrazol-4-yl]boronic acid CAS Name: [3-(2-fluoro-4-methylphenyl)-1-(triphenylmethyl)-4-pyrazolyl]boronic acid IUPAC Name: [3-(2-fluoro-4-methylphenyl)-1-tritylpyrazol-4-yl]boronic acid Traditional Name: [3-(2-fluoro-4-methyl-phenyl)-1-trityl-pyrazol-4-yl]boronic acid Formula: C29H24BFN2O2 MolecularWeight: 462.322463

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CN(N=C1C2=C(C=C(C=C2)C)F)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(O)O

Isomeric SMILES

B(C1=CN(N=C1C2=C(C=C(C=C2)C)F)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5)(O)O

InChI

InChI=1S/C29H24BFN2O2/c1-21-17-18-25(27(31)19-21)28-26(30(34)35)20-33(32-28)29(22-11-5-2-6-12-22,23-13-7-3-8-14-23)24-15-9-4-10-16-24/h2-20,34-35H,1H3