[3-(3,4-dimethoxyphenyl)-1-(triphenylmethyl)pyrazol-4-yl]boronic acid

Systemtic Name: [3-(3,4-dimethoxyphenyl)-1-(triphenylmethyl)pyrazol-4-yl]boronic acid Openeye Name: [3-(3,4-dimethoxyphenyl)-1-trityl-pyrazol-4-yl]boronic acid CAS Name: [3-(3,4-dimethoxyphenyl)-1-(triphenylmethyl)-4-pyrazolyl]boronic acid IUPAC Name: [3-(3,4-dimethoxyphenyl)-1-tritylpyrazol-4-yl]boronic acid Traditional Name: [3-(3,4-dimethoxyphenyl)-1-trityl-pyrazol-4-yl]boronic acid Formula: C30H27BN2O4 MolecularWeight: 490.35738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H27BN2O4/c1-36-27-19-18-22(20-28(27)37-2)29-26(31(34)35)21-33(32-29)30(23-12-6-3-7-13-23,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h3-21,34-35H,1-2H3