[2-oxidanylidene-4-phenylmethoxy-1-(phenylmethyl)pyrimidin-5-yl]boronic acid

Systemtic Name: [2-oxidanylidene-4-phenylmethoxy-1-(phenylmethyl)pyrimidin-5-yl]boronic acid Openeye Name: (1-benzyl-4-benzyloxy-2-oxo-pyrimidin-5-yl)boronic acid CAS Name: [2-oxo-4-phenylmethoxy-1-(phenylmethyl)-5-pyrimidinyl]boronic acid IUPAC Name: (1-benzyl-2-oxo-4-phenylmethoxypyrimidin-5-yl)boronic acid Traditional Name: (4-benzoxy-1-benzyl-2-keto-pyrimidin-5-yl)boronic acid Formula: C18H17BN2O4 MolecularWeight: 336.14958

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

B(C1=CN(C(=O)N=C1OCC2=CC=CC=C2)CC3=CC=CC=C3)(O)O

Isomeric SMILES

B(C1=CN(C(=O)N=C1OCC2=CC=CC=C2)CC3=CC=CC=C3)(O)O

InChI

InChI=1S/C18H17BN2O4/c22-18-20-17(25-13-15-9-5-2-6-10-15)16(19(23)24)12-21(18)11-14-7-3-1-4-8-14/h1-10,12,23-24H,11,13H2