(4-phenylmethoxy-2-piperidin-1-yl-pyrimidin-5-yl)boronic acid

Systemtic Name: (4-phenylmethoxy-2-piperidin-1-yl-pyrimidin-5-yl)boronic acid Openeye Name: [4-benzyloxy-2-(1-piperidyl)pyrimidin-5-yl]boronic acid CAS Name: [4-phenylmethoxy-2-(1-piperidinyl)-5-pyrimidinyl]boronic acid IUPAC Name: (4-phenylmethoxy-2-piperidin-1-ylpyrimidin-5-yl)boronic acid Traditional Name: (4-benzoxy-2-piperidino-pyrimidin-5-yl)boronic acid Formula: C16H20BN3O3 MolecularWeight: 313.1593

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CN=C(N=C1OCC2=CC=CC=C2)N3CCCCC3)(O)O

Isomeric SMILES

B(C1=CN=C(N=C1OCC2=CC=CC=C2)N3CCCCC3)(O)O

InChI

InChI=1S/C16H20BN3O3/c21-17(22)14-11-18-16(20-9-5-2-6-10-20)19-15(14)23-12-13-7-3-1-4-8-13/h1,3-4,7-8,11,21-22H,2,5-6,9-10,12H2